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1245652-55-4 | Propanoic acid, 2-[2-(3,4-difluorophenyl)hydrazinylidene]-
CAS No: 1245652-55-4 Catalog No: AG000MDX MDL No:MFCD16660258
Product Description
Catalog Number:
AG000MDX
Chemical Name:
Propanoic acid, 2-[2-(3,4-difluorophenyl)hydrazinylidene]-
CAS Number:
1245652-55-4
Molecular Formula:
C9H8F2N2O2
Molecular Weight:
214.1688
MDL Number:
MFCD16660258
IUPAC Name:
2-[(3,4-difluorophenyl)hydrazinylidene]propanoic acid
InChI:
InChI=1S/C9H8F2N2O2/c1-5(9(14)15)12-13-6-2-3-7(10)8(11)4-6/h2-4,13H,1H3,(H,14,15)
InChI Key:
LSTGHCMWOIFMAN-UHFFFAOYSA-N
SMILES:
OC(=O)C(=NNc1ccc(c(c1)F)F)C
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.055g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.172g/mol
Monoisotopic Mass:
214.055g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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