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147228-37-3

147228-37-3 | Benzenepentanoic acid, β-amino-, (βR)-

CAS No: 147228-37-3 Catalog No: AG001EQ7 MDL No:MFCD01076261

Product Description

Catalog Number:
AG001EQ7
Chemical Name:
Benzenepentanoic acid, β-amino-, (βR)-
CAS Number:
147228-37-3
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
MDL Number:
MFCD01076261
IUPAC Name:
(3R)-3-amino-5-phenylpentanoic acid
InChI:
InChI=1S/C11H15NO2/c12-10(8-11(13)14)7-6-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)/t10-/m1/s1
InChI Key:
CJJYCYZKUNRKFP-SNVBAGLBSA-N
SMILES:
N[C@@H](CC(=O)O)CCc1ccccc1

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
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:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  

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