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132209-86-0 | 2(3H)-Furanone, 3-heptylidenedihydro-5-methyl-
CAS No: 132209-86-0 Catalog No: AG0010DH MDL No:
Product Description
Catalog Number:
AG0010DH
Chemical Name:
2(3H)-Furanone, 3-heptylidenedihydro-5-methyl-
CAS Number:
132209-86-0
Molecular Formula:
C12H20O2
Molecular Weight:
196.2860
IUPAC Name:
3-heptylidene-5-methyloxolan-2-one
InChI:
InChI=1S/C12H20O2/c1-3-4-5-6-7-8-11-9-10(2)14-12(11)13/h8,10H,3-7,9H2,1-2H3
InChI Key:
SPOJRVXZEMNXKH-UHFFFAOYSA-N
SMILES:
CCCCCCC=C1CC(OC1=O)C
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.146g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.29g/mol
Monoisotopic Mass:
196.146g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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