CAS 68254-64-8 4-bromo-N-ethylaniline (HCID 11745656)

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Basic information

CAS: 68254-64-8
Standard SMILES: CCNc1ccc(Br)cc1
InChIKey: VYSQUDVPQJEULO-UHFFFAOYSA-N
Molecular formula: C8H10BrN
Average molar mass: 200.08 g/mol
Monoisotopic mass: 198.99966142

Names & identifiers

Preferred name: 4-bromo-N-ethylaniline
IUPAC: 4-bromo-N-ethylaniline
English name: N-Ethyl-4-broMo-benzenaMine
Molecular formula: C8H10BrN
Molecular weight: 200.08

Names & synonyms

4-bromo-N-ethylaniline68254-64-8DTXSID30471704RefChem:291077DTXCID40422520827-786-5Benzenamine, 4-bromo-N-ethyl-N-Ethyl-4-bromo-benzenamineMFCD032106814-bromo-N-ethylbenzenamineN-ethyl-4-bromoaniline4-bromo-N-ethyl-aniline

Show more names

SCHEMBL1284249SCHEMBL2990455SCHEMBL4607389SCHEMBL28297338SCHEMBL28873228VYSQUDVPQJEULO-UHFFFAOYSA-NTCA25464AKOS000241185

Database identifiers

CAS: 68254-64-8
PubChem CID: 11745656
DTXSID: DTXSID30471704
EC Number: 827-786-5
Nikkaji: J730.132D

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 12 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 87.3

Physicochemical properties

storage temp.: Store at Room Tem.
solubility: Dichloromethane;
form: Thick liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H312-H315-H319-H332-H335
Precautionary statements: 261 · P261-P280-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, P317, 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.