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113842-35-6 | 2(3H)-Furanone, 4-[2-(acetyloxy)ethyl]dihydro-5,5-dimethyl-, (R)- (9CI)
CAS No: 113842-35-6 Catalog No: AG0009V6 MDL No:
Product Description
Catalog Number:
AG0009V6
Chemical Name:
2(3H)-Furanone, 4-[2-(acetyloxy)ethyl]dihydro-5,5-dimethyl-, (R)- (9CI)
CAS Number:
113842-35-6
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
IUPAC Name:
2-(2,2-dimethyl-5-oxooxolan-3-yl)ethyl acetate
InChI:
InChI=1S/C10H16O4/c1-7(11)13-5-4-8-6-9(12)14-10(8,2)3/h8H,4-6H2,1-3H3
InChI Key:
XMCAETLGJSLJHZ-UHFFFAOYSA-N
SMILES:
CC(=O)OCC[C@@H]1CC(=O)OC1(C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.105g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.234g/mol
Monoisotopic Mass:
200.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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