CAS 608515-70-4 7-Chloroisoquinolin-5-amine (HCID 44558546)

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Basic information

CAS: 608515-70-4
Standard SMILES: Nc1cc(Cl)cc2cnccc12
InChIKey: YOMNAMATBRCQNB-UHFFFAOYSA-N
Molecular formula: C9H7ClN2
Average molar mass: 178.62 g/mol
Monoisotopic mass: 178.0297759

Names & identifiers

Preferred name: 7-Chloroisoquinolin-5-amine
IUPAC: 7-chloroisoquinolin-5-amine
English name: 5-Isoquinolinamine,7-chloro-(9CI)
Molecular formula: C9H7ClN2
Molecular weight: 178.62

Names & synonyms

608515-70-47-chloroisoquinolin-5-amine7-chloro-5-isoquinolinamine5-Isoquinolinamine,7-chloro-(9CI)5-Amino-7-chloroisoquinolineMFCD119736815-Isoquinolinamine, 7-chloro-SCHEMBL5656944DTXSID40659435YOMNAMATBRCQNB-UHFFFAOYSA-NAKOS015907623SY281332

Show more names

5-Isoquinolinamine, 7-chloro5-Isoquinolinamine,7-chloro-(9CI) ISO 9001：2015 REACH

CS-0132168F620391

Database identifiers

CAS: 608515-70-4
PubChem CID: 44558546
DTXSID: DTXSID40659435

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 12
Formal charge: 0
Complexity: 163

Physicochemical properties

storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P264b-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362+P364-P403+P233-P501c

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P264b-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362+P364-P403+P233-P501c