Home Other Building Blocks 2-[(3-methylphenyl)formamido]propanoic acid

2-[(3-methylphenyl)formamido]propanoic acid

CAS No.:
1397001-97-6
Catalog Number:
AG019JJX
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
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Product Description
Catalog Number:
AG019JJX
Chemical Name:
2-[(3-methylphenyl)formamido]propanoic acid
CAS Number:
1397001-97-6
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD00847719
IUPAC Name:
2-[(3-methylbenzoyl)amino]propanoic acid
InChI:
InChI=1S/C11H13NO3/c1-7-4-3-5-9(6-7)10(13)12-8(2)11(14)15/h3-6,8H,1-2H3,(H,12,13)(H,14,15)
InChI Key:
KPDBSQWRBLPDJF-UHFFFAOYSA-N
SMILES:
OC(=O)C(NC(=O)c1cccc(c1)C)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties