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19974-87-9 | 3-Piperidinol, 2-(diphenylmethyl)-1-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 19974-87-9 Catalog No: AG002CC5 MDL No:
Product Description
Catalog Number:
AG002CC5
Chemical Name:
3-Piperidinol, 2-(diphenylmethyl)-1-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
19974-87-9
Molecular Formula:
C25H28ClNO
Molecular Weight:
393.9489
IUPAC Name:
2-benzhydryl-1-benzylpiperidin-3-ol;hydrochloride
InChI:
InChI=1S/C25H27NO.ClH/c27-23-17-10-18-26(19-20-11-4-1-5-12-20)25(23)24(21-13-6-2-7-14-21)22-15-8-3-9-16-22;/h1-9,11-16,23-25,27H,10,17-19H2;1H
InChI Key:
ZBZQYPUHSMMZHO-UHFFFAOYSA-N
SMILES:
OC1CCCN(C1C(c1ccccc1)c1ccccc1)Cc1ccccc1.Cl
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.186g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
393.955g/mol
Monoisotopic Mass:
393.186g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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