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114361-75-0 | 2(3H)-Furanone, dihydro-5-(2-phenylethenyl)-
CAS No: 114361-75-0 Catalog No: AG000B5P MDL No:
Product Description
Catalog Number:
AG000B5P
Chemical Name:
2(3H)-Furanone, dihydro-5-(2-phenylethenyl)-
CAS Number:
114361-75-0
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
IUPAC Name:
5-(2-phenylethenyl)oxolan-2-one
InChI:
InChI=1S/C12H12O2/c13-12-9-8-11(14-12)7-6-10-4-2-1-3-5-10/h1-7,11H,8-9H2
InChI Key:
NIJXYOQCZNHOAX-UHFFFAOYSA-N
SMILES:
O=C1CCC(O1)C=Cc1ccccc1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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