2-Ethenylcyclohexan-1-ol

CAT: 0926-EBA10824-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-EBA10824-01Size:50 mg

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CAS Number

29108-24-5

MDL Number

MFCD30079455

Smiles

C=CC1CCCCC1O

Molecular Formula

C8H14O

Molecular Weight

126.2 g/mol

Controlled

Chemical Information

2-Ethenylcyclohexan-1-ol

CAS Number	29108-24-5
PubChem CID	5314569
IUPAC Name	2-ethenylcyclohexan-1-ol
Molecular Formula	C8H14O
Molecular Weight	126.20
XLogP	1.9
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	98

SMILES

C=CC1CCCCC1O

InChI

InChI=1S/C8H14O/c1-2-7-5-3-4-6-8(7)9/h2,7-9H,1,3-6H2

InChIKey

CEBPBNSXJDTCPS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 29108-24-5

CID: 5314569

Formula: C8H14O

MW: 126.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	126.20
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	126.104465066
Monoisotopic Mass	126.104465066
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	98.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FAA87741-01	2-Ethynylcyclohexan-1-ol
BAA74063-01	3-Ethenylcyclohexan-1-one
YXC51089-01	3-Ethynylcyclohexan-1-ol
EAA53476-01	3-Ethylcyclohexan-1-ol
RKC21968-01	3-Amino-1-ethynylcyclohexan-1-ol
ZLD00200-01	Rac- (1R,3R) -3-Ethenylcyclohexan-1-amine hydrochloride
HHC67929-01	4-Amino-1-ethylcyclohexan-1-ol
BAA97738-01	1-Methanesulfonylpropan-2-ol
BAA58947-01	2-Methoxypropan-1-ol
AAA69887	1-Phenylpropan-2-ol