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91650-62-3 | 2,5-Furandione, dihydro-3-(4-methylpentenyl)-
CAS No: 91650-62-3 Catalog No: AG006RJD MDL No:
Product Description
Catalog Number:
AG006RJD
Chemical Name:
2,5-Furandione, dihydro-3-(4-methylpentenyl)-
CAS Number:
91650-62-3
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
IUPAC Name:
3-(4-methylpent-1-enyl)oxolane-2,5-dione
InChI:
InChI=1S/C10H14O3/c1-7(2)4-3-5-8-6-9(11)13-10(8)12/h3,5,7-8H,4,6H2,1-2H3
InChI Key:
IRDKGSPFQMAXFJ-UHFFFAOYSA-N
SMILES:
CC(CC=CC1CC(=O)OC1=O)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.094g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.219g/mol
Monoisotopic Mass:
182.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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