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2-Benzoyl-5-norbornene,mixture of endo and exo

2-Benzoyl-5-norbornene,mixture of endo and exo

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Molecular Formula:

C14H14O

Molecular Weight:

198.26

CAS Number:

6056-35-5

Catalog Number:

6056-35-5

Product Information

Molecular Formula:

C14H14O

Molecular Weight:

198.26

Description

2-Benzoyl-5-norbornene,mixture of endo and exo (CAS# 6056-35-5 ) is a useful research chemical.

Synonyms

2-bicyclo[2.2.1]hept-5-enyl(phenyl)methanone

IUPAC Name

2-bicyclo[2.2.1]hept-5-enyl(phenyl)methanone

Canonical SMILES

C1C2CC(C1C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H14O/c15-14(11-4-2-1-3-5-11)13-9-10-6-7-12(13)8-10/h1-7,10,12-13H,8-9H2

InChI Key

RMHYEJKELLBHSV-UHFFFAOYSA-N

Boiling Point

122-124 °C / 2 mmHg (lit.)

Flash Point

235.4 °CF

Purity

97 %

Density

1.115 g/mL at 25 °C (lit.)

Refractive Index

n20/D 1.568 (lit.)

LogP

3.08150

Computed Properties

XLogP3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

198.104465066 g/mol

Monoisotopic Mass

198.104465066 g/mol

Topological Polar Surface Area

17.1Å²

Heavy Atom Count

Formal Charge

Complexity

286

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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2-Benzoyl-5-norbornene,mixture of endo and exo

Product Information

Computed Properties

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