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W508101

Sigma-Aldrich

1-Methyl-1,4-cyclohexadiene

≥96%, stabilized

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About This Item

Empirical Formula (Hill Notation):
C7H10
CAS Number:
4313-57-9
Molecular Weight:
94.15
EC Number:
224-329-6
MDL number:
MFCD00001538
UNSPSC Code:
12164502
PubChem Substance ID:
24902036
NACRES:
NA.21
Organoleptic:
faint
biological source:
synthetic
food allergen:
no known allergens

biological source

synthetic

Quality Level

300

Assay

≥96%

contains

BHT as stabilizer

refractive index

n20/D 1.471 (lit.)

bp

114-115 °C (lit.)

density

0.838 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

faint

SMILES string

CC1=CCC=CC1

InChI

1S/C7H10/c1-7-5-3-2-4-6-7/h2-3,6H,4-5H2,1H3

InChI key

QDXQAOGNBCOEQX-UHFFFAOYSA-N

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General description

1-Methyl-1,4-cyclohexadiene is reported to be produced by some Nodulosporium species along with other volatile organic compounds (VOCs).[1][2]

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Statements

H225,H319

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

51.8 °F - closed cup

Flash Point(C)

11 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MKBW8697V
MKBT4292V
MKBP5970V
32396MH
92896LJ

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János P Mészáros et al.
Dalton transactions (Cambridge, England : 2003), 49(23), 7977-7992 (2020-06-06)
Herein the design and synthesis of a new 8-hydroxyquinoline derivative, (S)-5-chloro-7-((proline-1-yl)methyl)8-hydroxyquinoline (HQCl-Pro), with good water solubility and multidrug resistance reversal activity are reported. In this work the proton dissociation processes of HQCl-Pro and its complex formation with [Rh(η5-C5Me5)(H2O)3]2+, [Ru(η6-p-cymene)(H2O)3]2+ and
An endophytic Nodulisporium sp. producing volatile organic compounds having bioactivity and fuel potential.
Mends MT, et al.
Journal of Petroleum & Environmental Biotechnology, 3(3) (2012)
Hypoxylon sp., an endophyte of Persea indica, producing 1, 8-cineole and other bioactive volatiles with fuel potential.
Tomsheck AR, et al.
Microbial Ecology, 60(4), 903-914 (2010)

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