Home Halogens DL-Alanine, N-(4-chlorobenzoyl)-

DL-Alanine, N-(4-chlorobenzoyl)-

CAS No.:
108462-95-9
Catalog Number:
AG007URA
Molecular Formula:
C10H10ClNO3
Molecular Weight:
227.6443
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Product Description
Catalog Number:
AG007URA
Chemical Name:
DL-Alanine, N-(4-chlorobenzoyl)-
CAS Number:
108462-95-9
Molecular Formula:
C10H10ClNO3
Molecular Weight:
227.6443
MDL Number:
MFCD00220131
IUPAC Name:
2-[(4-chlorobenzoyl)amino]propanoic acid
InChI:
InChI=1S/C10H10ClNO3/c1-6(10(14)15)12-9(13)7-2-4-8(11)5-3-7/h2-6H,1H3,(H,12,13)(H,14,15)
InChI Key:
SSHYAHPMLSAGGG-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)NC(=O)c1ccc(cc1)Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.644g/mol
Monoisotopic Mass:
227.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties