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88109-78-8 | 2-Propenoic acid, 3-fluoro-3-methoxy-, methyl ester
CAS No: 88109-78-8 Catalog No: AG004IS4 MDL No:
Product Description
Catalog Number:
AG004IS4
Chemical Name:
2-Propenoic acid, 3-fluoro-3-methoxy-, methyl ester
CAS Number:
88109-78-8
Molecular Formula:
C5H7FO3
Molecular Weight:
134.1057
IUPAC Name:
methyl 3-fluoro-3-methoxyprop-2-enoate
InChI:
InChI=1S/C5H7FO3/c1-8-4(6)3-5(7)9-2/h3H,1-2H3
InChI Key:
JSJXPGPVVQDKAN-UHFFFAOYSA-N
SMILES:
COC(=CC(=O)OC)F
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.038g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.106g/mol
Monoisotopic Mass:
134.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.6
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