1-Tetradecene

CAS: 1120-36-1 · C14H28

2D Structure

Loading 3D structure...

CAS Registry Number

1120-36-1

SMILES

C=CCCCCCCCCCCCC

InChI Key

HFDVRLIODXPAHB-UHFFFAOYSA-N

InChI

InChI=1S/C14H28/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3H,1,4-14H2,2H3

Comprehensive physical and chemical properties

Property	Value	Source
Molecular Mass	196.38 g/mol	CAS Common Chemistry
	196.37799999999996 g/mol	RDKit
	196.378 g/mol	RDKit
Density	0.77 g/cm³	CAS Common Chemistry
	0.7745 g/cm3 @ 20 °C	CAS Common Chemistry
Canonical SMILES	C=CCCCCCCCCCCCC	CAS Common Chemistry
InChI	InChI=1S/C14H28/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3H,1,4-14H2,2H3	CAS Common Chemistry
InChI Key	InChIKey=HFDVRLIODXPAHB-UHFFFAOYSA-N	CAS Common Chemistry
Melting Point	-12 °C	CAS Common Chemistry
Name	1-Tetradecene	CAS Common Chemistry
Heavy Atom Count	14	RDKit
Hydrogen Bond Acceptors	0	RDKit
Hydrogen Bond Donors	0	RDKit
Rotatable Bonds	11	RDKit
Aromatic Ring Count	0	RDKit
Topological Polar Surface Area	0.0 Å²	RDKit
LogP	5.483400000000005	RDKit
	5.4834	RDKit
	5.35	chempirical lib
Molar Refractivity	66.65800000000006 cm³/mol	RDKit
Ring Count	0	RDKit
Formal Charge	0	RDKit
Fraction Csp3	0.8571	RDKit
	0.86	chempirical lib
Exact Mass	196.219100896 g/mol	RDKit
Boiling Point	232-234 °C @ 760 Torr	CAS Common Chemistry

NMR, IR, and Mass spectral data

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

Convert

MW = 196.38 g/mol; density = 0.770 g/mL. Edit any field — others recompute live.

Mass (g) Moles (mmol) Moles (mol) Volume (mL)