Home Halogens methyl 2-chloro-3-(phenylformamido)propanoate

methyl 2-chloro-3-(phenylformamido)propanoate

CAS No.:
1702112-18-2
Catalog Number:
AG01BFWX
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
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Product Description
Catalog Number:
AG01BFWX
Chemical Name:
methyl 2-chloro-3-(phenylformamido)propanoate
CAS Number:
1702112-18-2
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
MDL Number:
MFCD28118747
IUPAC Name:
methyl 3-benzamido-2-chloropropanoate
InChI:
InChI=1S/C11H12ClNO3/c1-16-11(15)9(12)7-13-10(14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,13,14)
InChI Key:
UTKXGCLWAMOEOJ-UHFFFAOYSA-N
SMILES:
COC(=O)C(CNC(=O)c1ccccc1)Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties