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13921-90-9

13921-90-9 | (R)-3-Amino-3-phenylpropionic acid

CAS No: 13921-90-9 Catalog No: AG0032F6 MDL No:MFCD01076237

Product Description

Catalog Number:
AG0032F6
Chemical Name:
(R)-3-Amino-3-phenylpropionic acid
CAS Number:
13921-90-9
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD01076237
IUPAC Name:
(3R)-3-amino-3-phenylpropanoic acid
InChI:
InChI=1S/C9H11NO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m1/s1
InChI Key:
UJOYFRCOTPUKAK-MRVPVSSYSA-N
SMILES:
N[C@@H](c1ccccc1)CC(=O)O
EC Number:
604-118-9

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  

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