Home Other Building Blocks 3-[(2-hydroxyphenyl)carbamoyl]propanoic acid

3-[(2-hydroxyphenyl)carbamoyl]propanoic acid

CAS No.:
76475-61-1
Catalog Number:
AG019NUE
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019NUE
Chemical Name:
3-[(2-hydroxyphenyl)carbamoyl]propanoic acid
CAS Number:
76475-61-1
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD00570568
IUPAC Name:
4-(2-hydroxyanilino)-4-oxobutanoic acid
InChI:
InChI=1S/C10H11NO4/c12-8-4-2-1-3-7(8)11-9(13)5-6-10(14)15/h1-4,12H,5-6H2,(H,11,13)(H,14,15)
InChI Key:
KHPAYIYVNRVFCK-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1O)CCC(=O)O
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties