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Home > Fluorides > 247170-17-8
247170-17-8 | 2-Propenoic acid, 3-(2,4,5-trifluorophenyl)-
CAS No: 247170-17-8 Catalog No: AG002P6W MDL No:MFCD00061211
Product Description
Catalog Number:
AG002P6W
Chemical Name:
2-Propenoic acid, 3-(2,4,5-trifluorophenyl)-
CAS Number:
247170-17-8
Molecular Formula:
C9H5F3O2
Molecular Weight:
202.1300
MDL Number:
MFCD00061211
IUPAC Name:
(E)-3-(2,4,5-trifluorophenyl)prop-2-enoic acid
InChI:
InChI=1S/C9H5F3O2/c10-6-4-8(12)7(11)3-5(6)1-2-9(13)14/h1-4H,(H,13,14)/b2-1+
InChI Key:
KFVQEUPEGKJFCW-OWOJBTEDSA-N
SMILES:
OC(=O)C=Cc1cc(F)c(cc1F)F
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
202.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.132g/mol
Monoisotopic Mass:
202.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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