3-amino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Names
[ CAS No. ]:
53661-19-1
[ Name ]:
3-amino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
[Synonym ]:
3-Amino-4-cyano-5,6,7,8-tetrahydroisoquinoline
3-Amino-4-cyano-5,6,7,8-tetrahydroisochinoline
5,6,7,8-Tetrahydro-3-amino-4-isoquinolinecarbonitrile
KBLVALNQDHHHHA-UHFFFAOYSA
2-Amino-3-cyano-4,5-tetramethylenepyridine
4-Isoquinolinecarbonitrile,5,6,7,8-tetrahydro-3-amino
3-amino-5,6,7,8-tetrahydro-isoquinoline-4-carbonitrile
Chemical & Physical Properties
[ Density]:
1.21g/cm3
[ Boiling Point ]:
358.9ºC at 760 mmHg
[ Molecular Formula ]:
C10H11N3
[ Molecular Weight ]:
173.21400
[ Flash Point ]:
170.9ºC
[ Exact Mass ]:
173.09500
[ PSA ]:
62.70000
[ LogP ]:
1.99548
[ Index of Refraction ]:
1.606
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NW6984300
- CHEMICAL NAME :
- 4-Isoquinolinecarbonitrile, 5,6,7,8-tetrahydro-3-amino-
- CAS REGISTRY NUMBER :
- 53661-19-1
- BEILSTEIN REFERENCE NO. :
- 0394980
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H11-N3
- MOLECULAR WEIGHT :
- 173.24
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 24,346,1990
Safety Information
[ HS Code ]:
2933499090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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%