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2-Bromoethyl 2-phenylacetate

HCID 221889
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Basic information

CAS
6282-47-9
Standard SMILES
O=C(Cc1ccccc1)OCCBr
InChIKey
ZWWGBCATTSMQFJ-UHFFFAOYSA-N
Molecular formula
C10H11BrO2
Average molar mass
243.1 g/mol
Monoisotopic mass
241.99424

Names & identifiers

Preferred name
2-Bromoethyl 2-phenylacetate
IUPAC
2-bromoethyl 2-phenylacetate

Names & synonyms

6282-47-92-bromoethyl 2-phenylacetate2-bromoethyl phenylacetateSCHEMBL10835844DTXSID70278310NSC-6996Phenyl-acetic acid 2-bromo-ethyl ester

Database identifiers

CAS
6282-47-9
PubChem CID
221889
DTXSID
DTXSID70278310
Nikkaji
J329.195B

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
13
Formal charge
0
Complexity
153

Related reactions

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Compound notes

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