2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile

Modify Date: 2024-02-06 00:18:39

2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile Structure
2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile structure
Common Name 2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile
CAS Number 6687-82-7 Molecular Weight 209.24700
Density 1.258g/cm3 Boiling Point 367ºC at 760 mmHg
Molecular Formula C13H11N3 Melting Point N/A
MSDS N/A Flash Point 162.7ºC

 Names

Name 2-(3,4-dihydro-1H-isoquinolin-2-ylmethylidene)propanedinitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.258g/cm3
Boiling Point 367ºC at 760 mmHg
Molecular Formula C13H11N3
Molecular Weight 209.24700
Flash Point 162.7ºC
Exact Mass 209.09500
PSA 50.82000
LogP 1.91366
Index of Refraction 1.668

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OO3742500
CHEMICAL NAME :
Malononitrile, ((3,4-dihydro-2(1H)-isoquinolyl)methylene)-
CAS REGISTRY NUMBER :
6687-82-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H11-N3
MOLECULAR WEIGHT :
209.27
WISWESSER LINE NOTATION :
T66 CNT&J C1UYCN&CN

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 :
100 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#02881

 Safety Information

HS Code 2933499090

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

f0418-0008