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866-48-8 | Propanoic acid, 2-fluoro-2-methyl-3-oxo-, ethyl ester
CAS No: 866-48-8 Catalog No: AG004KXO MDL No:MFCD24680387
Product Description
Catalog Number:
AG004KXO
Chemical Name:
Propanoic acid, 2-fluoro-2-methyl-3-oxo-, ethyl ester
CAS Number:
866-48-8
Molecular Formula:
C6H9FO3
Molecular Weight:
148.1323
MDL Number:
MFCD24680387
IUPAC Name:
ethyl 2-fluoro-2-methyl-3-oxopropanoate
InChI:
InChI=1S/C6H9FO3/c1-3-10-5(9)6(2,7)4-8/h4H,3H2,1-2H3
InChI Key:
ZWMOZXYIFLAQRQ-UHFFFAOYSA-N
SMILES:
CC(C(=O)OCC)(C=O)F
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.133g/mol
Monoisotopic Mass:
148.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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