4,4,4-Trichloro-3-oxobutanoyl chloride

HCID 21391724CAS 58529-91-2
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Basic information

Standard SMILES
O=C(Cl)CC(=O)C(Cl)(Cl)Cl
InChIKey
QZBDPGNJFQJYGP-UHFFFAOYSA-N
Molecular formula
C4H2Cl4O2
Average molar mass
223.9 g/mol
Monoisotopic mass
221.88089

Names & identifiers

Preferred name
4,4,4-Trichloro-3-oxobutanoyl chloride
IUPAC
4,4,4-trichloro-3-oxobutanoyl chloride

Names & synonyms

4,4,4-Trichloro-3-oxobutanoyl chloride58529-91-2DTXSID60612885RefChem:284689DTXCID00563640SCHEMBL11728646QZBDPGNJFQJYGP-UHFFFAOYSA-Ngamma,gamma ,gamma -trichloroacetoacetyl chloride

Database identifiers

CAS
58529-91-2
PubChem CID
21391724
DTXSID
DTXSID60612885

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
34.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
10

Related reactions

1 records
New reaction record

Linked notes

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