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Home Aminos 3-[(1-Phenylethyl)amino]propanoic acid

3-[(1-Phenylethyl)amino]propanoic acid

CAS No.:
95350-05-3
Catalog Number:
AG006NIJ
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG006NIJ
Chemical Name:
3-[(1-Phenylethyl)amino]propanoic acid
CAS Number:
95350-05-3
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD00509401
IUPAC Name:
3-(1-phenylethylamino)propanoic acid
InChI:
InChI=1S/C11H15NO2/c1-9(12-8-7-11(13)14)10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3,(H,13,14)
InChI Key:
QYOGWZCNJDREPR-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)NCCC(=O)O
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:
-1.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties