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14563-35-0 | 2(3H)-Furanone, 5-(2,5-dimethoxyphenyl)dihydro-
CAS No: 14563-35-0 Catalog No: AG001D9D MDL No:
Product Description
Catalog Number:
AG001D9D
Chemical Name:
2(3H)-Furanone, 5-(2,5-dimethoxyphenyl)dihydro-
CAS Number:
14563-35-0
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
IUPAC Name:
5-(2,5-dimethoxyphenyl)oxolan-2-one
InChI:
InChI=1S/C12H14O4/c1-14-8-3-4-10(15-2)9(7-8)11-5-6-12(13)16-11/h3-4,7,11H,5-6H2,1-2H3
InChI Key:
XYCIKTXPBJTEKF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C1CCC(=O)O1)OC
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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