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136801-92-8 | Acetic acid, 2-(dihydro-5-methyl-2(3H)-furanylidene)-, methyl ester
CAS No: 136801-92-8 Catalog No: AG0012EE MDL No:
Product Description
Catalog Number:
AG0012EE
Chemical Name:
Acetic acid, 2-(dihydro-5-methyl-2(3H)-furanylidene)-, methyl ester
CAS Number:
136801-92-8
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
IUPAC Name:
methyl 2-(5-methyloxolan-2-ylidene)acetate
InChI:
InChI=1S/C8H12O3/c1-6-3-4-7(11-6)5-8(9)10-2/h5-6H,3-4H2,1-2H3
InChI Key:
OSKPHNFOIQIJSF-UHFFFAOYSA-N
SMILES:
COC(=O)C=C1CCC(O1)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.181g/mol
Monoisotopic Mass:
156.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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