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89630-76-2 | 2(3H)-Furanone, 3,3-dichlorodihydro-5-methyl-5-(1-methylethenyl)-
CAS No: 89630-76-2 Catalog No: AG003WPA MDL No:
Product Description
Catalog Number:
AG003WPA
Chemical Name:
2(3H)-Furanone, 3,3-dichlorodihydro-5-methyl-5-(1-methylethenyl)-
CAS Number:
89630-76-2
Molecular Formula:
C8H10Cl2O2
Molecular Weight:
209.0698
IUPAC Name:
3,3-dichloro-5-methyl-5-prop-1-en-2-yloxolan-2-one
InChI:
InChI=1S/C8H10Cl2O2/c1-5(2)7(3)4-8(9,10)6(11)12-7/h1,4H2,2-3H3
InChI Key:
OOUVGGXVCUDSIG-UHFFFAOYSA-N
SMILES:
CC(=C)C1(C)OC(=O)C(C1)(Cl)Cl
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.006g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.066g/mol
Monoisotopic Mass:
208.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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