4- (Dimethoxymethyl) cyclohex-1-ene

CAT: 0127-OR1045688-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1045688-01Size:100 mg

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CAS Number

7560-65-8

MDL Number

MFCD00225278

Purity

95%

Smiles

COC(OC)C1CCC=CC1

Chemical Information

Cyclohexene, 4-(dimethoxymethyl)-

CAS Number	7560-65-8
PubChem CID	111013
IUPAC Name	4-(dimethoxymethyl)cyclohexene
Molecular Formula	C9H16O2
Molecular Weight	156.22
XLogP	1.9
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	11
Formal Charge	0
Complexity	128

SMILES

COC(C1CCC=CC1)OC

InChI

InChI=1S/C9H16O2/c1-10-9(11-2)8-6-4-3-5-7-8/h3-4,8-9H,5-7H2,1-2H3

InChIKey

KVQDLLJFLVONBT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7560-65-8

CID: 111013

Formula: C9H16O2

MW: 156.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	156.22
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	156.115029749
Monoisotopic Mass	156.115029749
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	128
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR24507	1- (Nitromethyl) cyclohex-1-ene
PC8008-01	1- (Trifluorovinyl) cyclohex-1-ene
OR1102340-01	1- (Bromomethyl) cyclohex-1-ene
OR79416	Cyclohex-4-ene-1,2-dicarboxylic acid
OR1003865-01	Cyclohex-3-ene-1-carboxamide
PC1567E	1- (2-Bromotetrafluoroethyl) cyclohex-1-ene
OR1003317-01	Cyclohex-1-ene-1-carbonyl chloride
OR8858-01	Methyl cyclohex-1-ene-1-carboxylate
OR73374-01	4- (4-Hydroxy-4-methylpentyl) cyclohex-3-ene-1-carbaldehyde
OR0842-01	Methyl cyclohex-3-ene-1-carboxylate

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