9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl-

Modify Date: 2024-01-09 10:26:11

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure
9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- structure
Common Name 9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl-
CAS Number 3589-72-8 Molecular Weight 212.24700
Density 1.252g/cm3 Boiling Point 421.4ºC at 760mmHg
Molecular Formula C13H12N2O Melting Point 275ºC (dec.)
MSDS N/A Flash Point 139.7ºC

 Names

Name 6-methoxy-1-methyl-9H-pyrido[3,4-b]indole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.252g/cm3
Boiling Point 421.4ºC at 760mmHg
Melting Point 275ºC (dec.)
Molecular Formula C13H12N2O
Molecular Weight 212.24700
Flash Point 139.7ºC
Exact Mass 212.09500
PSA 37.91000
LogP 3.03310
Index of Refraction 1.706

 MSDS

Version 1.2
Regulation (EC) No 1907/2006

1 - Product and Company Information

Product Name6-METHOXYHARMAN

2 - Hazards Identification

3 - Composition/Information on Ingredients

Product NameCAS #EC noAnnex I
Index Number
6-METHOXYHARMAN3589-72-8 NoneNone
FormulaC13H12N2O
Molecular Weight 212,3000 AMU
SynonymsCoharmine * Isoharmine * 6-Methoxyharman *
6-Methoxyharmane *
6-Methoxy-1-methyl-9H-pyrido(3,4-b)indole

4 - First Aid Measures

AFTER INHALATION
If inhaled, remove to fresh air. If breathing becomes difficult,
call a physician.
AFTER SKIN CONTACT
In case of skin contact, flush with copious amounts of water for
at least 15 minutes. Remove contaminated clothing and shoes.
Call a physician.
AFTER EYE CONTACT
In case of contact with eyes, flush with copious amounts of
water for at least 15 minutes. Assure adequate flushing by
separating the eyelids with fingers. Call a physician.
AFTER INGESTION
If swallowed, wash out mouth with water provided person is
conscious. Call a physician.

5 - Fire Fighting Measures
SIGMAwww.molbase.com

EXTINGUISHING MEDIA
Suitable: Water spray. Carbon dioxide, dry chemical powder, or
appropriate foam.
SPECIAL RISKS
Specific Hazard(s): Emits toxic fumes under fire conditions.
SPECIAL PROTECTIVE EQUIPMENT FOR FIREFIGHTERS
Wear self-contained breathing apparatus and protective clothing
to prevent contact with skin and eyes.

6 - Accidental Release Measures

PROCEDURE(S) OF PERSONAL PRECAUTION(S)
Wear protective equipment.
METHODS FOR CLEANING UP
Sweep up, place in a bag and hold for waste disposal. Avoid
raising dust. Ventilate area and wash spill site after material
pickup is complete.

7 - Handling and Storage

STORAGE
Store at 2-8°C

8 - Exposure Controls / Personal Protection

ENGINEERING CONTROLS
Mechanical exhaust required.
PERSONAL PROTECTIVE EQUIPMENT
Special Protective Measures: Wear appropriate government approved
respirator, chemical-resistant gloves, safety goggles, other
protective clothing.

9 - Physical and Chemical Properties

AppearancePhysical State: Solid
PropertyValueAt Temperature or Pressure
pHN/A
BP/BP RangeN/A
MP/MP RangeN/A
Flash PointN/A
FlammabilityN/A
Autoignition TempN/A
Oxidizing PropertiesN/A
Explosive PropertiesN/A
Explosion LimitsN/A
Vapor PressureN/A
Partition CoefficientN/A
ViscosityN/A
Vapor DensityN/A
Saturated Vapor Conc.N/A
Evaporation RateN/A
Bulk DensityN/A
Decomposition Temp.N/A
SIGMAwww.molbase.com
Solvent ContentN/A
Water ContentN/A
Surface TensionN/A
ConductivityN/A
Miscellaneous DataN/A
SolubilityN/A

10 - Stability and Reactivity

STABILITY
Stable: Stable.
HAZARDOUS DECOMPOSITION PRODUCTS
Hazardous Decomposition Products: Carbon monoxide, carbon dioxide,
and nitrogen oxides.
HAZARDOUS POLYMERIZATION
Hazardous Polymerization: Will not occur

11 - Toxicological Information

RTECS NUMBER: UV0168000
ACUTE TOXICITY
LD50
Intraperitoneal
Mouse
650 MG/KG
Remarks: Kidney, Ureter, Bladder:Urine volume increased.
ROUTE OF EXPOSURE
Multiple Routes: May be harmful by inhalation, ingestion, or
skin absorption. May cause irritation.
CONDITIONS AGGRAVATED BY EXPOSURE
The toxicological properties have not been thoroughly
investigated.

12 - Ecological Information

No data available.

13 - Disposal Considerations

SUBSTANCE DISPOSAL
Dissolve or mix the material with a combustible solvent and burn
in a chemical incinerator equipped with an afterburner and
scrubber. Observe all federal, state, and local environmental
regulations.

14 - Transport Information

RID/ADR
Non-hazardous for road transport.
IMDG
Non-hazardous for sea transport.
IATA
SIGMAwww.molbase.com
Non-hazardous for air transport.

15 - Regulatory Information

Caution: Substance not yet fully tested (EU).
COUNTRY SPECIFIC INFORMATION
Germany
WGK: 3
Self-Classification

16 - Other Information

WARRANTY
The above information is believed to be correct but does not
purport to be all inclusive and shall be used only as a guide. The
information in this document is based on the present state of our
knowledge and is applicable to the product with regard to
appropriate safety precautions. It does not represent any
guarantee of the properties of the product. Inc.,
shall not be held liable for any damage resulting from handling or
from contact with the above product. See reverse side of invoice
or packing slip for additional terms and conditions of sale.
Copyright 2010 Co. License granted to make
unlimitedpaper copies for internal use only.
DISCLAIMER
For R&D use only. Not for drug, household or other uses.
SIGMAwww.molbase.com


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV0168000
CHEMICAL NAME :
9H-Pyrido(3,4-b)indole, 6-methoxy-1-methyl-
CAS REGISTRY NUMBER :
3589-72-8
BEILSTEIN REFERENCE NO. :
0178687
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H12-N2-O
MOLECULAR WEIGHT :
212.27
WISWESSER LINE NOTATION :
T B656 EN HNJ F1 LO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
650 mg/kg
TOXIC EFFECTS :
Kidney, Ureter, Bladder - urine volume increased
REFERENCE :
FAZMAE Fortschritte der Arzneimittelforschung. Progress in Drug Research. (Birkhauser Boston, Inc., c/o Springer-Verlag New York, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1959- Volume(issue)/page/year: 6,75,1963

 Safety Information

HS Code 2933990090

 Synthetic Route

~40%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Sapi, Janos; Patigny, Dominique; Laronze, Jean-Yves Heterocycles, 1999 , vol. 51, # 2 p. 361 - 364

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Sapi, Janos; Patigny, Dominique; Laronze, Jean-Yves Heterocycles, 1999 , vol. 51, # 2 p. 361 - 364

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Schott, Yvonne; Decker, Michael; Rommelspacher, Hans; Lehmann, Jochen Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 22 p. 5840 - 5843

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Spaeth; Lederer Chemische Berichte, 1930 , vol. 63, p. 2102,2106

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Cuny, Gregory D.; Ulyanova, Natalia P.; Patnaik, Debasis; Liu, Ji-Feng; Lin, Xiangjie; Auerbach, Ken; Ray, Soumya S.; Xian, Jun; Glicksman, Marcie A.; Stein, Ross L.; Higgins, Jonathan M.G. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 5 p. 2015 - 2019

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Cuny, Gregory D.; Ulyanova, Natalia P.; Patnaik, Debasis; Liu, Ji-Feng; Lin, Xiangjie; Auerbach, Ken; Ray, Soumya S.; Xian, Jun; Glicksman, Marcie A.; Stein, Ross L.; Higgins, Jonathan M.G. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 5 p. 2015 - 2019

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Song, Yongcheng; Wang, Jian; Teng, Su Fern; Kesuma, Djohan; Deng, Yu; Duan, Jinao; Wang, Jerry H.; Qi, Robert Zhong; Sim, Mui Mui Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 7 p. 1129 - 1132

~%

9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl- Structure

9H-Pyrido[3,4-b...

CAS#:3589-72-8

Literature: Spaeth; Lederer Chemische Berichte, 1930 , vol. 63, p. 2102,2106

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

6-Methoxy Harman
Coharmine
6-Methoxyharmane
Isoharmine
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