Home Aminos 2-{[(3-methylphenyl)carbamoyl]amino}acetic acid

2-{[(3-methylphenyl)carbamoyl]amino}acetic acid

CAS No.:
133115-37-4
Catalog Number:
AG019MPP
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
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Product Description
Catalog Number:
AG019MPP
Chemical Name:
2-{[(3-methylphenyl)carbamoyl]amino}acetic acid
CAS Number:
133115-37-4
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD08444862
IUPAC Name:
2-[(3-methylphenyl)carbamoylamino]acetic acid
InChI:
InChI=1S/C10H12N2O3/c1-7-3-2-4-8(5-7)12-10(15)11-6-9(13)14/h2-5H,6H2,1H3,(H,13,14)(H2,11,12,15)
InChI Key:
VZOMJJJMNAGVRE-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)C)NCC(=O)O
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties