6-Chloro-8-aminoquinoline

HCID 79618

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Basic information

CAS: 5470-75-7
Standard SMILES: Nc1cc(Cl)cc2cccnc12
InChIKey: RRFMPCSQKFOUFO-UHFFFAOYSA-N
Molecular formula: C9H7ClN2
Average molar mass: 178.62 g/mol
Monoisotopic mass: 178.0297759

Names & identifiers

Preferred name: 6-Chloro-8-aminoquinoline
IUPAC: 6-chloroquinolin-8-amine
English name: 6-chloroquinolin-8-amine
Molecular formula: C9H7ClN2
Molecular weight: 178.62

Names & synonyms

5470-75-76-Chloro-8-aminoquinoline8-Quinolinamine, 6-chloro-NSC 27981DTXSID1063930RefChem:104416DTXCID9041788RRFMPCSQKFOUFO-UHFFFAOYSA-N6-chloroquinolin-8-amine8-Amino-6-chloroquinolineMFCD090491015EBB5KL32K

Show more names

NSC 27986-Chloroquinolin-8-amine 97%

NSC-279816-chloro-8-quinolylamine6-Chloro-8-quinolinamineNSC27981UNII-5EBB5KL32K6-chloroquinolin-8-ylamine6-chloranylquinolin-8-amine(6-chloro-8-quinolyl)amine

Database identifiers

CAS: 5470-75-7
PubChem CID: 79618
DTXSID: DTXSID1063930
ChEMBL: CHEMBL1594047
UNII: 5EBB5KL32K
EC Number: 959-503-7
Nikkaji: J81.047I

Properties

Computed structural properties

XLogP: 2.4
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
Appearance: Off-white to light yellow Solid
FDA UNII: 5 EBB5KL32K · 5EBB5KL32K
EPA Substance Registry System: 8 · 8-Quinolinamine, 6-chloro- (5470-75-7)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
TSCA: TSCA listed
HS Code: 2933499090 · 2933499090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.