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Home Other Building Blocks 4-(4-Fluoroanilino)-4-oxobut-2-enoic acid

4-(4-Fluoroanilino)-4-oxobut-2-enoic acid

CAS No.:
60252-79-1
Catalog Number:
AG00EAG9
Molecular Formula:
C10H8FNO3
Molecular Weight:
209.1738
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$63
- +
5g
97%
1 week
United States
$114
- +
Product Description
Catalog Number:
AG00EAG9
Chemical Name:
4-(4-Fluoroanilino)-4-oxobut-2-enoic acid
CAS Number:
60252-79-1
Molecular Formula:
C10H8FNO3
Molecular Weight:
209.1738
MDL Number:
MFCD00029808
IUPAC Name:
(E)-4-(4-fluoroanilino)-4-oxobut-2-enoic acid
InChI:
InChI=1S/C10H8FNO3/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(14)15/h1-6H,(H,12,13)(H,14,15)/b6-5+
InChI Key:
NRDZVHHPNZDWRA-AATRIKPKSA-N
SMILES:
O=C(Nc1ccc(cc1)F)/C=C/C(=O)O
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
209.049g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.176g/mol
Monoisotopic Mass:
209.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties