Home Other Building Blocks 2-[N-(2-phenylethyl)acetamido]acetic acid

2-[N-(2-phenylethyl)acetamido]acetic acid

CAS No.:
1423027-84-2
Catalog Number:
AG01A3C7
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
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Product Description
Catalog Number:
AG01A3C7
Chemical Name:
2-[N-(2-phenylethyl)acetamido]acetic acid
CAS Number:
1423027-84-2
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD22741233
IUPAC Name:
2-[acetyl(2-phenylethyl)amino]acetic acid
InChI:
InChI=1S/C12H15NO3/c1-10(14)13(9-12(15)16)8-7-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,15,16)
InChI Key:
KTAQAILHRQDFQP-UHFFFAOYSA-N
SMILES:
OC(=O)CN(C(=O)C)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:
1  
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties