Home Other Building Blocks 2-hydroxy-5-(prop-2-enamido)benzoic acid

2-hydroxy-5-(prop-2-enamido)benzoic acid

CAS No.:
39833-78-8
Catalog Number:
AG01BS71
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
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Product Description
Catalog Number:
AG01BS71
Chemical Name:
2-hydroxy-5-(prop-2-enamido)benzoic acid
CAS Number:
39833-78-8
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD00591632
IUPAC Name:
2-hydroxy-5-(prop-2-enoylamino)benzoic acid
InChI:
InChI=1S/C10H9NO4/c1-2-9(13)11-6-3-4-8(12)7(5-6)10(14)15/h2-5,12H,1H2,(H,11,13)(H,14,15)
InChI Key:
QQSAUUOOHVYERA-UHFFFAOYSA-N
SMILES:
C=CC(=O)Nc1ccc(c(c1)C(=O)O)O
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
207.185g/mol
Monoisotopic Mass:
207.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties