5-Bromo-2-propionylphenyl methanesulfonate

HCID 10924809

Basic information

CAS
215815-08-0
Standard SMILES
CCC(=O)c1ccc(Br)cc1OS(C)(=O)=O
InChIKey
OTYZMSGPZHZGGI-UHFFFAOYSA-N
Molecular formula
C10H11BrO4S
Average molar mass
307.16 g/mol
Monoisotopic mass
305.95614

Names & identifiers

Preferred name
5-Bromo-2-propionylphenyl methanesulfonate
IUPAC
(5-bromo-2-propanoylphenyl) methanesulfonate
English name
5-Bromo-2-propionylphenyl methanesulfonate
Molecular formula
C10H11BrO4S
Molecular weight
307.16

Names & synonyms

215815-08-05-BROMO-2-PROPIONYLPHENYL METHANESULFONATE(5-bromo-2-propanoylphenyl) methanesulfonateC10H11BrO4S1-Propanone,1-[4-bromo-2-[(methylsulfonyl)oxy]phenyl]-5-bromo-2-propanoylphenyl methanesulfonateSCHEMBL4264335DTXSID10448575OTYZMSGPZHZGGI-UHFFFAOYSA-NAKOS027384325(5-bromo-2-propanoyl-phenyl) methanesulfonateF095465
Show more names
1-[4-Bromo-2-[(methylsulfonyl)oxy]phenyl]-1-propanone1-Propanone, 1-[4-bromo-2-[(methylsulfonyl)oxy]phenyl]-
Methanesulfonic acid 5bromo-2-propionyl-phenyl esterMethanesulfonic acid 5-bromo-2-propionyl-phenyl ester

Database identifiers

CAS
215815-08-0
PubChem CID
10924809
DTXSID
DTXSID10448575
Nikkaji
J1.139.383G

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
68.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16

Physicochemical properties

Boiling point
435.6 · 435.6±45.0 °C(Predicted)
Density
1.545 · 1.545±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers2 total

凯试(上海)科技有限公司021-50135380 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

10 records

Compound notes

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