CAS 14813-01-5 | 3-Piperidinol, 1-(phenylmethyl)- | CAS Number 14813-01-5

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14813-01-5 | 3-Piperidinol, 1-(phenylmethyl)-

CAS No: 14813-01-5 Catalog No: AG001FH2 MDL No:MFCD00023734

Product Description

Catalog Number:

AG001FH2

Chemical Name:

3-Piperidinol, 1-(phenylmethyl)-

CAS Number:

14813-01-5

Molecular Formula:

C12H17NO

Molecular Weight:

191.2695

MDL Number:

MFCD00023734

IUPAC Name:

1-benzylpiperidin-3-ol

InChI:

InChI=1S/C12H17NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-3,5-6,12,14H,4,7-10H2

InChI Key:

UTTCOAGPVHRUFO-UHFFFAOYSA-N

SMILES:

OC1CCCN(C1)Cc1ccccc1

EC Number:

238-881-0

NSC Number:

111182

Properties

Complexity:

166

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.274g/mol

Monoisotopic Mass:

191.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501