1-Methylcyclohexene

CAT: 1596-AR-H07557-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-H07557-06Size:250 Units

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CAS Number

591-49-1

Molecular Formula

C7H12

Molecular Weight

96.17

API Name

Hexene

Chemical Information

1-Methylcyclohexene

1-methyl-Cyclohexene is a hydrocarbon.

CAS Number	591-49-1
PubChem CID	11574
IUPAC Name	1-methylcyclohexene
Molecular Formula	C7H12
Molecular Weight	96.17
XLogP	2.4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	80

SMILES

CC1=CCCCC1

InChI

InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h5H,2-4,6H2,1H3

InChIKey

CTMHWPIWNRWQEG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 591-49-1

CID: 11574

Formula: C7H12

MW: 96.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	96.17
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	96.093900383
Monoisotopic Mass	96.093900383
Topological Polar Surface Area	0 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	80
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-M03259-01	Methylcyclohexane
AR-E10533-01	1,1,1-Trichloroethane
AR-K00999-01	1,1,1-Kestopentaose
AR-E01999-01	1,1,1-Trichloro-Trifluoroethane
AR-B08225-01	Bortezomib Stereo Isomers Mixture (1:1:1:1)
AR-D06471-01	3- (1-Cyano-1,1-diphenylmethyl) -1-tosylpyrrolidine
AR-I01381-01	1,1'-Carbonyldiimidazole
AR-C08588-01	1,1-Dichlorocyclohexane
AR-S10247-01	1,1-Dicyclopentylsilanediol
AR-P02079-01	1,1'-Ethylenedipiperazine

Catalog	Name
HY-W004338-01	1-Methylcyclohexene
OR1043766-01	4-Methylcyclohexene
sc-279439	Methylcyclohexene-1,2-dicarboxylic anhydride
M15025-01	2-Methylcyclohexene 95%
FI146812	(3S,6R) -3-Isopropyl-6-methylcyclohexene
OR1102939-01	3-Methylcyclohexene-boronic Acid Pinacol Ester (isomers mixture)
OF59775-01	1,1,1,1,1-Kestoheptaose
N2864-5.1	1,1,1,1-Kestohexaose
112040	1,1,1,1-Kestohexose