2-Methyl-1-hexene - CAS 6094-02-6

Catalog:	BB030865
Product Name:	2-Methyl-1-hexene
CAS:	6094-02-6
Synonyms:	2-methylhex-1-ene

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Computed Properties

IUPAC Name:	2-methylhex-1-ene
Description:	2-Methyl-1-hexene (CAS# 6094-02-6) is a useful research chemical compound.
Molecular Weight:	98.19
Molecular Formula:	C7H14
Canonical SMILES:	CCCCC(=C)C
InChI:	InChI=1S/C7H14/c1-4-5-6-7(2)3/h2,4-6H2,1,3H3
InChI Key:	IRUDSQHLKGNCGF-UHFFFAOYSA-N
Boiling Point:	92 °C (lit.)
Density:	0.697 g/mL at 25°C(lit.)
Appearance:	Clear, Colorless liquid
LogP:	2.75270
Vapor Pressure:	60.9 [mmHg]

Publication Number	Title	Priority Date
CN-113463178-A	Electrolytic polishing solution and electrolytic polishing method for tungsten-based wire or sheet	20210723
CN-113087826-A	External electron donor composition, olefin polymerization catalyst and application thereof, and polyolefin and preparation method thereof	20210420
CN-113214415-A	Composite external electron donor, olefin polymerization catalyst and application thereof, and polyolefin and preparation method thereof	20210420
CN-113214416-A	Combined external electron donor, olefin polymerization catalyst and application thereof, and polyolefin and preparation method thereof	20210420
CN-113248535-A	Sila 1, 3-diether compound, preparation method thereof, olefin polymerization catalyst and olefin polymerization method	20210420

PMID	Publication Date	Title	Journal
19385593	20090514	Rate constants for the gas-phase reactions of NO3 radicals and O3 with C6-C14 1-alkenes and 2-methyl-1-alkenes at 296 +/- 2 K	The journal of physical chemistry. A
19127989	20090205	Rate constants for the gas-phase reactions of OH radicals with a series of C6-C14 alkenes at 299 +/- 2 K	The journal of physical chemistry. A
17168575	20061222	Calculated effect of substitutions on the regioselectivity of cyclization of alpha-sulfenyl-, alpha-sulfinyl-, and alpha-sulfonyl-(5R)-5-hexenyl radicals	The Journal of organic chemistry
15153015	20040528	The regiochemistry of cyclization of alpha-sulfenyl-, alpha-sulfinyl-, and alpha-sulfonyl-5-hexenyl radicals: procedures leading to regioselective syntheses of cyclic sulfones and sulfoxides	The Journal of organic chemistry

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GHS Hazard Statement:	H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P280, P301+P310, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	53.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	98.109550447
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	98.109550447
Rotatable Bond Count:	3
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6