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122059-38-5 | 3(2H)-Furanone, 2,2-dimethyl-5-(2-phenylethenyl)-
CAS No: 122059-38-5 Catalog No: AG0016PH MDL No:
Product Description
Catalog Number:
AG0016PH
Chemical Name:
3(2H)-Furanone, 2,2-dimethyl-5-(2-phenylethenyl)-
CAS Number:
122059-38-5
Molecular Formula:
C14H14O2
Molecular Weight:
214.2598
IUPAC Name:
2,2-dimethyl-5-(2-phenylethenyl)furan-3-one
InChI:
InChI=1S/C14H14O2/c1-14(2)13(15)10-12(16-14)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3
InChI Key:
RDWFSLOZEJGVCE-UHFFFAOYSA-N
SMILES:
O=C1C=C(OC1(C)C)C=Cc1ccccc1
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.099g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.264g/mol
Monoisotopic Mass:
214.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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