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13458-54-3 | 4-(3-Chlorophenyl)-4-hydroxy-1-methylpiperidine
CAS No: 13458-54-3 Catalog No: AG01F9T4 MDL No:
Product Description
Catalog Number:
AG01F9T4
Chemical Name:
4-(3-Chlorophenyl)-4-hydroxy-1-methylpiperidine
CAS Number:
13458-54-3
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
IUPAC Name:
4-(3-chlorophenyl)-1-methylpiperidin-4-ol
InChI:
InChI=1S/C12H16ClNO/c1-14-7-5-12(15,6-8-14)10-3-2-4-11(13)9-10/h2-4,9,15H,5-8H2,1H3
InChI Key:
BLBPQYXWLFOJCX-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)(O)c1cccc(c1)Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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