3-Methyl-but-2-enoic acid 4-bromo-phenyl ester

HCID 733797

Basic information

Standard SMILES
CC(C)=CC(=O)Oc1ccc(Br)cc1
InChIKey
RDOXILXISZRPFQ-UHFFFAOYSA-N
Molecular formula
C11H11BrO2
Average molar mass
255.11 g/mol

Names & identifiers

Preferred name
3-Methyl-but-2-enoic acid 4-bromo-phenyl ester
IUPAC
(4-bromophenyl) 3-methylbut-2-enoate

Names & synonyms

4-bromophenyl 3-methyl-2-butenoate3-Methyl-but-2-enoic acid 4-bromo-phenyl esterSCHEMBL5736870RDOXILXISZRPFQ-UHFFFAOYSA-NHMS1594P084-bromophenyl 3-methylbut-2-enoate(4-bromophenyl) 3,3-dimethylacrylateAKOS002256289(4-bromophenyl) 3,3-dimethyl-acrylateST50755114

Database identifiers

PubChem CID
733797

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
14

Related reactions

35 records

Compound notes

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