5-Bromo-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)

HCID 45074003CAS 923591-51-9

Completing data — usually done within a minute

Substructure search Find similar structures

Basic information

Standard SMILES: Brc1cccc2c1CCNC2.Cl
InChIKey: SBMVDLGSHBOIOK-UHFFFAOYSA-N
Molecular formula: C9H11BrClN
Average molar mass: 248.551 g/mol
Monoisotopic mass: 246.97633913

Names & identifiers

Preferred name: 5-Bromo-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
IUPAC: 5-Bromo-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
English name: Isoquinoline, 5-bromo-1,2,3,4-tetrahydro-, hydrochloride
Molecular formula: C9H11BrClN
Molecular weight: 248.55

Names & synonyms

5-BroMo-1,2,3,4-tetrahdyroisoquinoline hydrochlorideIsoquinoline, 5-bromo-1,2,3,4-tetrahydro-, hydrochloride5-bromo-1,2,3,4-tetrahydro-Isoquinoline hydrochloride (1:1)Isoquinoline, 5-bromo-1,2,3,4-tetrahydro-, hydrochloride (1:1)

Database identifiers

CAS: 923591-51-9
PubChem CID: 45074003
DTXSID: DTXSID10662875
EC Number: 676-394-9

Properties

Physicochemical properties

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
form: powder
color: Light yellow
InChI: InChI=1S/C9H10BrN.ClH/c10-9-3-1-2-7-6-11-5-4-8(7)9;/h1-3,11H,4-6H2;1H
InChIKey: SBMVDLGSHBOIOK-UHFFFAOYSA-N
SMILES: BrC1C=CC=C2CNCCC=12.Cl
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HS Code: 2933499090 · 2933499090

Safety & regulation

Safety data

hs_code: 2933499090
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313