Home Other Building Blocks (2R)-2-(3-phenylpropanamido)propanoic acid

(2R)-2-(3-phenylpropanamido)propanoic acid

CAS No.:
1308958-74-8
Catalog Number:
AG01B86P
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
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Product Description
Catalog Number:
AG01B86P
Chemical Name:
(2R)-2-(3-phenylpropanamido)propanoic acid
CAS Number:
1308958-74-8
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD16050450
IUPAC Name:
2-(3-phenylpropanoylamino)propanoic acid
InChI:
InChI=1S/C12H15NO3/c1-9(12(15)16)13-11(14)8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,13,14)(H,15,16)
InChI Key:
WHQOVJKEOBDJIV-UHFFFAOYSA-N
SMILES:
C[C@H](C(=O)O)NC(=O)CCc1ccccc1
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties