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760-80-5 | 2-Propenoic acid,2-fluoro-, ethyl ester
CAS No: 760-80-5 Catalog No: AG005G7M MDL No:MFCD04038707
Product Description
Catalog Number:
AG005G7M
Chemical Name:
2-Propenoic acid,2-fluoro-, ethyl ester
CAS Number:
760-80-5
Molecular Formula:
C5H7FO2
Molecular Weight:
118.1063
MDL Number:
MFCD04038707
IUPAC Name:
ethyl 2-fluoroprop-2-enoate
InChI:
InChI=1S/C5H7FO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InChI Key:
DJMOYRIAWTXGEY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=C)F
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.043g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.107g/mol
Monoisotopic Mass:
118.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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