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Vinyl dichloroacetate

HCID 82052
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Basic information

CAS
7561-04-8
Standard SMILES
C=COC(=O)C(Cl)Cl
InChIKey
ZBCLTORTGNOIGM-UHFFFAOYSA-N
Molecular formula
C4H4Cl2O2
Average molar mass
154.98 g/mol
Monoisotopic mass
153.9588348

Names & identifiers

Preferred name
Vinyl dichloroacetate
IUPAC
ethenyl 2,2-dichloroacetate
English name
Dichloroacetic acid vinyl ester
Molecular formula
C4H4Cl2O2
Molecular weight
0

Names & synonyms

Vinyl dichloroacetateethenyl 2,2-dichloroacetate7561-04-8vinyldichloroacetateEthenyl dichloroacetateVinyl dichloro acetateSCHEMBL164714DTXSID70226518ZBCLTORTGNOIGM-UHFFFAOYSA-NDDR69536S2EINECS 231-455-5Acetic acid, dichloro-, vinyl ester
Show more names
Dichloroacetic acid vinyl ester
Acetic acid, 2,2-dichloro-, ethenyl esterNS00047155

Database identifiers

CAS
7561-04-8
PubChem CID
82052
DTXSID
DTXSID70226518
UNII
DDR69536S2
EC Number
231-455-5
Nikkaji
J307.880I

Properties

Computed structural properties

XLogP
2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
100

Related reactions

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Compound notes

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