Home Aminos p-[(1-oxoallyl)amino]benzoic acid

p-[(1-oxoallyl)amino]benzoic acid

CAS No.:
15286-98-3
Catalog Number:
AG00B517
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
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Product Description
Catalog Number:
AG00B517
Chemical Name:
p-[(1-oxoallyl)amino]benzoic acid
CAS Number:
15286-98-3
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD00584317
IUPAC Name:
4-(prop-2-enoylamino)benzoic acid
InChI:
InChI=1S/C10H9NO3/c1-2-9(12)11-8-5-3-7(4-6-8)10(13)14/h2-6H,1H2,(H,11,12)(H,13,14)
InChI Key:
MNIDYHCRWJBKLX-UHFFFAOYSA-N
SMILES:
C=CC(=O)Nc1ccc(cc1)C(=O)O
EC Number:
239-330-7
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties