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1607-31-4 | 1,3-Dioxolan-2-one, 4-[(acetyloxy)methyl]-
CAS No: 1607-31-4 Catalog No: AG001S56 MDL No:
Product Description
Catalog Number:
AG001S56
Chemical Name:
1,3-Dioxolan-2-one, 4-[(acetyloxy)methyl]-
CAS Number:
1607-31-4
Molecular Formula:
C6H8O5
Molecular Weight:
160.1247
IUPAC Name:
(2-oxo-1,3-dioxolan-4-yl)methyl acetate
InChI:
InChI=1S/C6H8O5/c1-4(7)9-2-5-3-10-6(8)11-5/h5H,2-3H2,1H3
InChI Key:
UCWHARBCMODQPN-UHFFFAOYSA-N
SMILES:
CC(=O)OCC1COC(=O)O1
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.037g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.125g/mol
Monoisotopic Mass:
160.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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