1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-(4-chlorophenyl)piperidin-4-ol

2.1.2 InChI

InChI=1S/C11H14ClNO/c12-9-1-3-10(4-2-9)13-7-5-11(14)6-8-13/h1-4,11,14H,5-8H2

2.1.3 InChI Key

ZUBDFEMHDHJGCX-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CN(CCC1O)C2=CC=C(C=C2)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1-(4-chlorophenyl)piperidin-4-ol

2. 119836-12-3

3. Schembl2158833

4. Zinc34415641

5. 4-hydroxy-(4-chlorophenyl)piperidine

6. Akos022304945

7. Db-061660

8. Ft-0710744

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₄ClNO
Molecular Weight	211.69 g/mol
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	211.0763918 g/mol
Monoisotopic Mass	211.0763918 g/mol
Topological Polar Surface Area	23.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	172
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

CAS 119836-12-3