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Cyclohexadiene, methyl-

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Name

Cyclohexadiene, methyl-

EINECS 250-269-5
CAS No. 30640-46-1 Density 0.848 g/cm3
PSA 0.00000 LogP 2.13860
Solubility N/A Melting Point N/A
Formula C7H10 Boiling Point 115.8 °C at 760 mmHg
Molecular Weight 94.15 Flash Point 4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 30640-46-1 (METHYL CYCLOHEXADIENE) Hazard Symbols N/A
Synonyms

Methylcyclohexadiene;

 

Cyclohexadiene, methyl- Specification

The Cyclohexadiene, methyl-, with the CAS registry number 30640-46-1, is also known as Methylcyclohexadiene. Its EINECS registry number is 250-269-5. This chemical's molecular formula is C7H10 and molecular weight is 94.15. Its IUPAC name is called 1-methylcyclohexa-1,3-diene.

Physical properties of Cyclohexadiene, methyl-: (1)ACD/LogP: 3.06; (2)ACD/LogD (pH 5.5): 3.06; (3)ACD/LogD (pH 7.4): 3.06; (4)ACD/BCF (pH 5.5): 124.9; (5)ACD/BCF (pH 7.4): 124.9; (6)ACD/KOC (pH 5.5): 1102.4; (7)ACD/KOC (pH 7.4): 1102.4; (8)Index of Refraction: 1.48; (9)Molar Refractivity: 31.58 cm3; (10)Molar Volume: 111 cm3; (11)Surface Tension: 26.6 dyne/cm; (12)Density: 0.848 g/cm3; (13)Flash Point: 4 °C; (14)Enthalpy of Vaporization: 33.95 kJ/mol; (15)Boiling Point: 115.8 °C at 760 mmHg; (16)Vapour Pressure: 22.3 mmHg at 25°C.

Preparation of Cyclohexadiene, methyl-: this chemical can be prepared by 1,2-dibromo-4-methyl-cyclohexane. This reaction will need reagent quinoline.

Cyclohexadiene, methyl- can be prepared by 1,2-dibromo-4-methyl-cyclohexane

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=CCC1
(2)InChI: InChI=1S/C7H10/c1-7-5-3-2-4-6-7/h2-3,5H,4,6H2,1H3
(3)InChIKey: QMFJIJFIHIDENY-UHFFFAOYSA-N

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