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128887-78-5 | 3,4-Piperidinediol, 1,3-dimethyl-4,6-diphenyl-, (3R,4R,6R)-rel-
CAS No: 128887-78-5 Catalog No: AG000YGG MDL No:
Product Description
Catalog Number:
AG000YGG
Chemical Name:
3,4-Piperidinediol, 1,3-dimethyl-4,6-diphenyl-, (3R,4R,6R)-rel-
CAS Number:
128887-78-5
Molecular Formula:
C19H23NO2
Molecular Weight:
297.3914
IUPAC Name:
1,3-dimethyl-4,6-diphenylpiperidine-3,4-diol
InChI:
InChI=1S/C19H23NO2/c1-18(21)14-20(2)17(15-9-5-3-6-10-15)13-19(18,22)16-11-7-4-8-12-16/h3-12,17,21-22H,13-14H2,1-2H3
InChI Key:
LWCAYNPNSLDGPO-UHFFFAOYSA-N
SMILES:
CN1C[C@@](C)(O)[C@](C[C@@H]1c1ccccc1)(O)c1ccccc1
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.173g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.398g/mol
Monoisotopic Mass:
297.173g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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