Pentadecylcyclohexane

CAT: 0127-OR1079245-02Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1079245-02Size:25 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

6006-95-7

MDL Number

MFCD00058952

Purity

>98.0%

Smiles

CCCCCCCCCCCCCCCC1CCCCC1

Chemical Information

Pentadecylcyclohexane

CAS Number	6006-95-7
PubChem CID	22328
IUPAC Name	pentadecylcyclohexane
Molecular Formula	C21H42
Molecular Weight	294.6
XLogP	11.1
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	14
Heavy Atom Count	21
Formal Charge	0
Complexity	190

SMILES

CCCCCCCCCCCCCCCC1CCCCC1

InChI

InChI=1S/C21H42/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21-19-16-14-17-20-21/h21H,2-20H2,1H3

InChIKey

ZNUABQHWFGTOCO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6006-95-7

CID: 22328

Formula: C21H42

MW: 294.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	294.6
XLogP3	11.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	14
Exact Mass	294.328651340
Monoisotopic Mass	294.328651340
Topological Polar Surface Area	0 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	190
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
sc-487972	Pentadecylcyclohexane