Home Aminos methyl 2-(phenylamino)butanoate

methyl 2-(phenylamino)butanoate

CAS No.:
77165-36-7
Catalog Number:
AG01AHPG
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
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Product Description
Catalog Number:
AG01AHPG
Chemical Name:
methyl 2-(phenylamino)butanoate
CAS Number:
77165-36-7
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD12775604
IUPAC Name:
methyl 2-anilinobutanoate
InChI:
InChI=1S/C11H15NO2/c1-3-10(11(13)14-2)12-9-7-5-4-6-8-9/h4-8,10,12H,3H2,1-2H3
InChI Key:
SQLUKUXIOGDAKO-UHFFFAOYSA-N
SMILES:
CCC(C(=O)OC)Nc1ccccc1
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties