Home Aminos 2-(ethylamino)-3-phenylpropanoic acid

2-(ethylamino)-3-phenylpropanoic acid

CAS No.:
64991-34-0
Catalog Number:
AG01E9U8
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
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Product Description
Catalog Number:
AG01E9U8
Chemical Name:
2-(ethylamino)-3-phenylpropanoic acid
CAS Number:
64991-34-0
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD00101990
IUPAC Name:
2-(ethylamino)-3-phenylpropanoic acid
InChI:
InChI=1S/C11H15NO2/c1-2-12-10(11(13)14)8-9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3,(H,13,14)
InChI Key:
ZHLKFJCNKZEBNG-UHFFFAOYSA-N
SMILES:
CCNC(C(=O)O)Cc1ccccc1
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:
2  
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2  
Properties