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16735-23-2

16735-23-2 | 1-Propanone, 2-amino-3-hydroxy-1-phenyl-, hydrochloride (1:1)

CAS No: 16735-23-2 Catalog No: AG001XBB MDL No:

Product Description

Catalog Number:
AG001XBB
Chemical Name:
1-Propanone, 2-amino-3-hydroxy-1-phenyl-, hydrochloride (1:1)
CAS Number:
16735-23-2
Molecular Formula:
C9H12ClNO2
Molecular Weight:
201.6501
IUPAC Name:
2-amino-3-hydroxy-1-phenylpropan-1-one
InChI:
InChI=1S/C9H11NO2/c10-8(6-11)9(12)7-4-2-1-3-5-7/h1-5,8,11H,6,10H2
InChI Key:
XQRAVJOTJAQCIZ-UHFFFAOYSA-N
SMILES:
OCC(C(=O)c1ccccc1)N.Cl

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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