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201863-97-0 | Benzenebutanoic acid, γ-amino-, (γR)-
CAS No: 201863-97-0 Catalog No: AG0027W8 MDL No:MFCD10698691
Product Description
Catalog Number:
AG0027W8
Chemical Name:
Benzenebutanoic acid, γ-amino-, (γR)-
CAS Number:
201863-97-0
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD10698691
IUPAC Name:
(4R)-4-amino-4-phenylbutanoic acid
InChI:
InChI=1S/C10H13NO2/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m1/s1
InChI Key:
QCHLDIVWWGHNQB-SECBINFHSA-N
SMILES:
N[C@@H](c1ccccc1)CCC(=O)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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