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13088-34-1 | 2(5H)-Furanone, 5-(dichloromethylene)-
CAS No: 13088-34-1 Catalog No: AG000V2M MDL No:
Product Description
Catalog Number:
AG000V2M
Chemical Name:
2(5H)-Furanone, 5-(dichloromethylene)-
CAS Number:
13088-34-1
Molecular Formula:
C5H2Cl2O2
Molecular Weight:
164.9742
IUPAC Name:
5-(dichloromethylidene)furan-2-one
InChI:
InChI=1S/C5H2Cl2O2/c6-5(7)3-1-2-4(8)9-3/h1-2H
InChI Key:
MZAHPGKVGDZXSH-UHFFFAOYSA-N
SMILES:
ClC(=C1C=CC(=O)O1)Cl
NSC Number:
90877
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.943g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.969g/mol
Monoisotopic Mass:
163.943g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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