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13133-96-5

13133-96-5 | 2(3H)-Furanone, dihydro-5,5-dimethyl-4-phenyl-

CAS No: 13133-96-5 Catalog No: AG000VYP MDL No:

Product Description

Catalog Number:
AG000VYP
Chemical Name:
2(3H)-Furanone, dihydro-5,5-dimethyl-4-phenyl-
CAS Number:
13133-96-5
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
5,5-dimethyl-4-phenyloxolan-2-one
InChI:
InChI=1S/C12H14O2/c1-12(2)10(8-11(13)14-12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
InChI Key:
CULAWTLHZMUYLR-UHFFFAOYSA-N
SMILES:
O=C1CC(C(O1)(C)C)c1ccccc1
NSC Number:
108984

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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