1-Methyl-3-Propylcyclohexane

CAT: 1299-RG-A261138-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-A261138-01Size:10 mg

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CAS Number

4291-80-9

Synonyms

1-methyl-3-propylcyclohexane

Molecular Formula

C10H20

Molecular Weight

140.27

Product Name Synonym

1-methyl-3-propylcyclohexane

Chemical Information

1-Methyl-3-propylcyclohexane

CAS Number	4291-80-9
PubChem CID	138178
IUPAC Name	1-methyl-3-propylcyclohexane
Molecular Formula	C10H20
Molecular Weight	140.27
XLogP	4.8
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	86

SMILES

CCCC1CCCC(C1)C

InChI

InChI=1S/C10H20/c1-3-5-10-7-4-6-9(2)8-10/h9-10H,3-8H2,1-2H3

InChIKey

HFHJBWYDQAWSIA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4291-80-9

CID: 138178

Formula: C10H20

MW: 140.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	140.27
XLogP3	4.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	140.156500638
Monoisotopic Mass	140.156500638
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	86
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

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Catalog	Name
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OR7071	5-Propylcyclohexane-1,3-dione
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OR1008172-01	(4-Methoxyphenyl) 4-Propylcyclohexane-1-Carboxylate