Home Carbonyls 3-Amino-3-(4-(methoxycarbonyl)phenyl)propanoic acid

3-Amino-3-(4-(methoxycarbonyl)phenyl)propanoic acid

CAS No.:
181519-49-3
Catalog Number:
AG00AUNC
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$114
- +
1g
98%
1 week
United States
$191
- +
Product Description
Catalog Number:
AG00AUNC
Chemical Name:
3-Amino-3-(4-(methoxycarbonyl)phenyl)propanoic acid
CAS Number:
181519-49-3
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
MDL Number:
MFCD03002438
IUPAC Name:
3-amino-3-(4-methoxycarbonylphenyl)propanoic acid
InChI:
InChI=1S/C11H13NO4/c1-16-11(15)8-4-2-7(3-5-8)9(12)6-10(13)14/h2-5,9H,6,12H2,1H3,(H,13,14)
InChI Key:
MQDNHGACHBBMQD-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C(CC(=O)O)N
Properties
Complexity:
259  
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:
5  
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:
89.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6  
Properties