1-methyl-6-nitro-9H-pyrido[3,4-b]indole

Modify Date: 2024-04-08 20:12:12

1-methyl-6-nitro-9H-pyrido[3,4-b]indole Structure
1-methyl-6-nitro-9H-pyrido[3,4-b]indole structure
Common Name 1-methyl-6-nitro-9H-pyrido[3,4-b]indole
CAS Number 38314-91-9 Molecular Weight 227.21900
Density 1.444g/cm3 Boiling Point 476.7ºC at 760 mmHg
Molecular Formula C12H9N3O2 Melting Point N/A
MSDS N/A Flash Point 242.1ºC

 Names

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

 Chemical & Physical Properties

Density 1.444g/cm3
Boiling Point 476.7ºC at 760 mmHg
Molecular Formula C12H9N3O2
Molecular Weight 227.21900
Flash Point 242.1ºC
Exact Mass 227.06900
PSA 74.50000
LogP 3.45590
Index of Refraction 1.777

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV0360500
CHEMICAL NAME :
9H-Pyrido(3,4-b)indole, 1-methyl-6-nitro-
CAS REGISTRY NUMBER :
38314-91-9
BEILSTEIN REFERENCE NO. :
0225341
LAST UPDATED :
199806
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H9-N3-O2
MOLECULAR WEIGHT :
227.24
WISWESSER LINE NOTATION :
T B656 EN HMJ F1 LNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
63 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#12130

 Synthetic Route

~74%

1-methyl-6-nitro-9H-pyrido[3,4-b]indole Structure

1-methyl-6-nitr...

CAS#:38314-91-9

Literature: Song, Hongjian; Liu, Yongxian; Liu, Yuxiu; Wang, Lizhong; Wang, Qingmin Journal of Agricultural and Food Chemistry, 2014 , vol. 62, # 5 p. 1010 - 1018

~%

1-methyl-6-nitro-9H-pyrido[3,4-b]indole Structure

1-methyl-6-nitr...

CAS#:38314-91-9

Literature: Snyder et al. Journal of the American Chemical Society, 1948 , vol. 70, p. 219

~%

1-methyl-6-nitro-9H-pyrido[3,4-b]indole Structure

1-methyl-6-nitr...

CAS#:38314-91-9

Literature: Song, Hongjian; Liu, Yongxian; Liu, Yuxiu; Wang, Lizhong; Wang, Qingmin Journal of Agricultural and Food Chemistry, 2014 , vol. 62, # 5 p. 1010 - 1018

~%

1-methyl-6-nitro-9H-pyrido[3,4-b]indole Structure

1-methyl-6-nitr...

CAS#:38314-91-9

Literature: Song, Hongjian; Liu, Yongxian; Liu, Yuxiu; Wang, Lizhong; Wang, Qingmin Journal of Agricultural and Food Chemistry, 2014 , vol. 62, # 5 p. 1010 - 1018

 Synonyms

6-Nitroharman
6-nitro-1-methyl-9H-pyrido[3,4-b]indole
6-nitro-harmane
9H-Pyrido(3,4-b)indole,1-methyl-6-nitro