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10140-87-1 | Ethanol, 1,2-dichloro-, 1-acetate
CAS No: 10140-87-1 Catalog No: AG0004EQ MDL No:
Product Description
Catalog Number:
AG0004EQ
Chemical Name:
Ethanol, 1,2-dichloro-, 1-acetate
CAS Number:
10140-87-1
Molecular Formula:
C4H6Cl2O2
Molecular Weight:
156.9952
IUPAC Name:
1,2-dichloroethyl acetate
InChI:
InChI=1S/C4H6Cl2O2/c1-3(7)8-4(6)2-5/h4H,2H2,1H3
InChI Key:
QRNBACUXNLBSDC-UHFFFAOYSA-N
SMILES:
CC(=O)OC(CCl)Cl
EC Number:
233-398-1
UN Number:
1993
Properties
Complexity:
84.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.974g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.99g/mol
Monoisotopic Mass:
155.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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