Cyclohexanone,2-(phenylmethyl)-

CAS
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Purity
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CAS
946-33-8
Size
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Purity
96%
Price
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Availability
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Quantity
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Catalog Number

ACM946338

Product Name

Cyclohexanone,2-(phenylmethyl)-

Structure

Structure

CAS

946-33-8

Category

Heterocyclic Organic Compound

Synonyms

2-Benzylcyclohexanone, 2-Benzylcyclohexan-1-one, Cyclohexanone, 2-(phenylmethyl)-, 549959_ALDRICH, NSC149930, CID98945, EINECS 213-420-6, LT03382635, 946-33-8

IUPAC Name

2-benzylcyclohexan-1-one

Molecular Weight

188.27

Molecular Formula

C₁₃H₁₆O

InChI Key

CUYLPYBYCYQGCE-UHFFFAOYSA-N

Boiling Point

103-105ºC0.2 mm Hg(lit.)

Melting Point

28-30ºC

Flash Point

127.5ºC

Density

1.03

Exact Mass

188.12000

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

1

H-Bond Donor

0

Safety Description

S24/25

WGK Germany

3

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of cyclohexanone, 2-(phenylmethyl)-?

The molecular formula is C13H16O.

What is the molecular weight of cyclohexanone, 2-(phenylmethyl)-?

The molecular weight is 188.26 g/mol.

What is the IUPAC name of cyclohexanone, 2-(phenylmethyl)-?

The IUPAC name is 2-benzylcyclohexan-1-one.

What is the InChI of cyclohexanone, 2-(phenylmethyl)-?

The InChI is InChI=1S/C13H16O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2.

What is the InChIKey of cyclohexanone, 2-(phenylmethyl)-?

The InChIKey is CUYLPYBYCYQGCE-UHFFFAOYSA-N.

What is the canonical SMILES of cyclohexanone, 2-(phenylmethyl)-?

The canonical SMILES is C1CCC(=O)C(C1)CC2=CC=CC=C2.

What is the CAS number of cyclohexanone, 2-(phenylmethyl)-?

The CAS number is 946-33-8.

What is the European Community (EC) number of cyclohexanone, 2-(phenylmethyl)-?

The European Community (EC) number is 213-420-6.

What is the DSSTox Substance ID of cyclohexanone, 2-(phenylmethyl)-?

The DSSTox Substance ID is DTXSID501314740.

Is cyclohexanone, 2-(phenylmethyl)- a canonicalized compound?

Yes, it is a canonicalized compound.

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