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125973-98-0 | 2(5H)-Furanone, 4-[(acetyloxy)chloromethyl]-
CAS No: 125973-98-0 Catalog No: AG000QLR MDL No:
Product Description
Catalog Number:
AG000QLR
Chemical Name:
2(5H)-Furanone, 4-[(acetyloxy)chloromethyl]-
CAS Number:
125973-98-0
Molecular Formula:
C7H7ClO4
Molecular Weight:
190.5811
IUPAC Name:
[chloro-(5-oxo-2H-furan-3-yl)methyl] acetate
InChI:
InChI=1S/C7H7ClO4/c1-4(9)12-7(8)5-2-6(10)11-3-5/h2,7H,3H2,1H3
InChI Key:
ILVDSUQKKNCONG-UHFFFAOYSA-N
SMILES:
CC(=O)OC(C1=CC(=O)OC1)Cl
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.003g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.579g/mol
Monoisotopic Mass:
190.003g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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