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2,2,2-Trichloro-n,n-bis(2-chloroethyl)acetamide

HCID 247202
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Basic information

CAS
50711-76-7
Standard SMILES
O=C(N(CCCl)CCCl)C(Cl)(Cl)Cl
InChIKey
HSJUFMHPSVECPR-UHFFFAOYSA-N
Molecular formula
C6H8Cl5NO
Average molar mass
287.4 g/mol
Monoisotopic mass
284.904852

Names & identifiers

Preferred name
2,2,2-Trichloro-n,n-bis(2-chloroethyl)acetamide
IUPAC
2,2,2-trichloro-N,N-bis(2-chloroethyl)acetamide

Names & synonyms

50711-76-72,2,2-trichloro-n,n-bis(2-chloroethyl)acetamideNSC61565NCIOpen2_002769DTXSID80964959NSC-61565Acetamide,2,2-trichloro-N,N-bis(2-chloroethyl)-

Database identifiers

CAS
50711-76-7
PubChem CID
247202
DTXSID
DTXSID80964959

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
13
Formal charge
0
Complexity
163

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