3-pyridin-3-ylisoquinolin-1-amine

Modify Date: 2025-09-18 15:11:59

3-pyridin-3-ylisoquinolin-1-amine Structure
3-pyridin-3-ylisoquinolin-1-amine structure
Common Name 3-pyridin-3-ylisoquinolin-1-amine
CAS Number 38172-59-7 Molecular Weight 221.25700
Density 1.246g/cm3 Boiling Point 449.4ºC at 760 mmHg
Molecular Formula C14H11N3 Melting Point N/A
MSDS N/A Flash Point 256.1ºC

 Names

Name 3-pyridin-3-ylisoquinolin-1-amine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.246g/cm3
Boiling Point 449.4ºC at 760 mmHg
Molecular Formula C14H11N3
Molecular Weight 221.25700
Flash Point 256.1ºC
Exact Mass 221.09500
PSA 51.80000
LogP 3.46020
Index of Refraction 1.706
InChIKey HKTHEKGLHMSGCU-UHFFFAOYSA-N
SMILES Nc1nc(-c2cccnc2)cc2ccccc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NW6852152
CHEMICAL NAME :
Isoquinoline, 1-amino-3-(3-pyridyl)-
CAS REGISTRY NUMBER :
38172-59-7
BEILSTEIN REFERENCE NO. :
0745887
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H11-N3
MOLECULAR WEIGHT :
221.28

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 :
>100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CHTPBA Chimica Therapeutica. (Paris, France) V.1-8, 1965-73. For publisher information, see EJMCA5. Volume(issue)/page/year: 7,185,1972

 Safety Information

HS Code 2933990090

 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

3-pyridin-3-yl-isoquinolin-1-ylamine
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