3-(4-Bromophenyl)-3-chloro-2-propenal

HCID 26438

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 14063-78-6
Standard SMILES: O=CC=C(Cl)c1ccc(Br)cc1
InChIKey: BMEIVZSKOZFHRN-UHFFFAOYSA-N
Molecular formula: C9H6BrClO
Average molar mass: 245.5 g/mol
Monoisotopic mass: 243.92906

Names & identifiers

Preferred name: 3-(4-Bromophenyl)-3-chloro-2-propenal
IUPAC: 3-(4-bromophenyl)-3-chloroprop-2-enal

Names & synonyms

DTXSID3012855193-(4-Bromophenyl)-3-chloro-2-propenalRefChem:492740DTXCID3017162033-(4-bromophenyl)-3-chloropropenal3-(4-BROMOPHENYL)-3-CHLOROPROP-2-ENAL(2Z)-3-(4-Bromophenyl)-3-chloroacrylaldehyde2-Propenal, 3-(4-bromophenyl)-3-chloro-, (Z)-SCHEMBL25592343-(4-bromophenyl)-3-chloro-prop-2-enal

Database identifiers

CAS: 14063-78-6
PubChem CID: 26438
DTXSID: DTXSID301285519

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 12
Formal charge: 0
Complexity: 183

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…