Methanesulfonic acid 3-chloro-1-phenyl-propyl ester

HCID 57985877
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Basic information

Standard SMILES
CS(=O)(=O)OC(CCCl)c1ccccc1
InChIKey
KGTLAWKXWSHQBO-UHFFFAOYSA-N
Molecular formula
C10H13ClO3S
Average molar mass
248.73 g/mol

Names & identifiers

Preferred name
Methanesulfonic acid 3-chloro-1-phenyl-propyl ester
IUPAC
(3-chloro-1-phenylpropyl) methanesulfonate

Names & synonyms

871351-43-8SCHEMBL2073576KGTLAWKXWSHQBO-UHFFFAOYSA-N3-chloro-1-phenylpropyl methanesulfonateMethanesulfonic acid 3-chloro-1-phenyl-propyl ester

Database identifiers

PubChem CID
57985877

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
51.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
15

Related reactions

11 records
New reaction record

Compound notes

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