Home Carbonyls 2-[(methoxycarbonyl)amino]-3-phenylpropanoic acid

2-[(methoxycarbonyl)amino]-3-phenylpropanoic acid

CAS No.:
77357-58-5
Catalog Number:
AG019XR9
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019XR9
Chemical Name:
2-[(methoxycarbonyl)amino]-3-phenylpropanoic acid
CAS Number:
77357-58-5
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
MDL Number:
MFCD11128982
IUPAC Name:
2-(methoxycarbonylamino)-3-phenylpropanoic acid
InChI:
InChI=1S/C11H13NO4/c1-16-11(15)12-9(10(13)14)7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,12,15)(H,13,14)
InChI Key:
QGICDLYPUUZBIV-UHFFFAOYSA-N
SMILES:
COC(=O)NC(C(=O)O)Cc1ccccc1
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.084g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
223.228g/mol
Monoisotopic Mass:
223.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties