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132209-84-8 | 2(3H)-Furanone, 3-(cyclohexylmethylene)dihydro-5-methyl-, (3E)-
CAS No: 132209-84-8 Catalog No: AG0010DI MDL No:
Product Description
Catalog Number:
AG0010DI
Chemical Name:
2(3H)-Furanone, 3-(cyclohexylmethylene)dihydro-5-methyl-, (3E)-
CAS Number:
132209-84-8
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
IUPAC Name:
3-(cyclohexylmethylidene)-5-methyloxolan-2-one
InChI:
InChI=1S/C12H18O2/c1-9-7-11(12(13)14-9)8-10-5-3-2-4-6-10/h8-10H,2-7H2,1H3
InChI Key:
HJLVPHHUURFMLO-UHFFFAOYSA-N
SMILES:
CC1OC(=O)/C(=C/C2CCCCC2)/C1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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