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20397-61-9 | 2-Propenoic acid, 2-fluoro-3-phenyl-, (2Z)-
CAS No: 20397-61-9 Catalog No: AG00297T MDL No:MFCD00004222
Product Description
Catalog Number:
AG00297T
Chemical Name:
2-Propenoic acid, 2-fluoro-3-phenyl-, (2Z)-
CAS Number:
20397-61-9
Molecular Formula:
C9H7FO2
Molecular Weight:
166.1491
MDL Number:
MFCD00004222
IUPAC Name:
(Z)-2-fluoro-3-phenylprop-2-enoic acid
InChI:
InChI=1S/C9H7FO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-6H,(H,11,12)/b8-6-
InChI Key:
QONCEXMULRJPPY-VURMDHGXSA-N
SMILES:
F/C(=C\c1ccccc1)/C(=O)O
EC Number:
206-508-0
NSC Number:
102780
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
166.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.151g/mol
Monoisotopic Mass:
166.043g/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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