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51096-49-2 | S-(-);-2-Benzylamino-1-phenylethanol
CAS No: 51096-49-2 Catalog No: AG003AYZ MDL No:MFCD03427123
Product Description
Catalog Number:
AG003AYZ
Chemical Name:
S-(-);-2-Benzylamino-1-phenylethanol
CAS Number:
51096-49-2
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
MDL Number:
MFCD03427123
IUPAC Name:
(1S)-2-(benzylamino)-1-phenylethanol
InChI:
InChI=1S/C15H17NO/c17-15(14-9-5-2-6-10-14)12-16-11-13-7-3-1-4-8-13/h1-10,15-17H,11-12H2/t15-/m1/s1
InChI Key:
XAOCLQUZOIZSHV-OAHLLOKOSA-N
SMILES:
O[C@@H](c1ccccc1)CNCc1ccccc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
227.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.307g/mol
Monoisotopic Mass:
227.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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