CAS 1671-75-6 | 1-Heptanone, 1-phenyl- | CAS Number 1671-75-6

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1671-75-6 | 1-Heptanone, 1-phenyl-

CAS No: 1671-75-6 Catalog No: AG001X4Q MDL No:MFCD00009539

Product Description

Catalog Number:

AG001X4Q

Chemical Name:

1-Heptanone, 1-phenyl-

CAS Number:

1671-75-6

Molecular Formula:

C13H18O

Molecular Weight:

190.2814

MDL Number:

MFCD00009539

IUPAC Name:

1-phenylheptan-1-one

InChI:

InChI=1S/C13H18O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

InChI Key:

UXMQORVHJMUQFD-UHFFFAOYSA-N

SMILES:

CCCCCCC(=O)c1ccccc1

EC Number:

216-802-0

UNII:

KX07WP06JY

Properties

Complexity:

157

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.286g/mol

Monoisotopic Mass:

190.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1

Literature

Title	Journal
Kinetic performance comparison of a capillary monolithic and a fused-core column in micro-scale liquid chromatography.	Journal of chromatography. A 20121026
An extraction technique for analytical sample preparation in aqueous solution based on controlling dispersion of ionic surfactant assemblies in isotachophoretic migration.	Journal of chromatography. A 20110107
Inhibition of carbonyl reductase activity in pig heart by alkyl phenyl ketones.	Journal of enzyme inhibition and medicinal chemistry 20070201
Effect of surfactant counterion and organic modifier on the properties of surfactant vesicles in electrokinetic chromatography.	Journal of separation science 20050801