CAS 139399-67-0 3-Bromoquinolin-8-amine (HCID 15112545)

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Basic information

CAS: 139399-67-0
Standard SMILES: Nc1cccc2cc(Br)cnc12
InChIKey: NDROWMOVSVLHDO-UHFFFAOYSA-N
Molecular formula: C9H7BrN2
Average molar mass: 223.07 g/mol
Monoisotopic mass: 221.97926032

Names & identifiers

Preferred name: 3-Bromoquinolin-8-amine
IUPAC: 3-bromoquinolin-8-amine
English name: 3-Bromoquinolin-8-amine
Molecular formula: C9H7BrN2
Molecular weight: 223.07

Names & synonyms

3-Bromoquinolin-8-amine139399-67-0DTXSID205684103-Bromo-8-QuinolinamineRefChem:499414DTXCID20519184894-950-08-Quinolinamine, 3-bromo-MFCD110402168-amino-3-bromoquinoline3-bromo-quinolin-8-ylamineSCHEMBL2197162

Show more names

-Bromoquinolin-8-amine

AKOS016005016CS-W006441SB71567SY041636EN300-137494AMY261253-Bromo-8-aminoquinolinePFA39967

Database identifiers

CAS: 139399-67-0
PubChem CID: 15112545
DTXSID: DTXSID20568410
EC Number: 894-950-0

Properties

Computed structural properties

XLogP: 2.5
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.: 2 · 2-8°C, protect from light
Appearance: Light brown to black Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Applications · 1 item

Uses3-Bromoquinolin-8-amine acts as a reagent for the synthesis and structure activity relationship of 3-(arylsulfonyl)-8-(piperidin-4-yl amino)quinoline derivatives as 5-HT6 receptor antagonists for the treatment of Alzheimer''s disease and Schizophrenia. Also acts as a reagent for the synthesis of certain 8-aminoquinolines and antimalarias.