ChemicalBook--->CAS DataBase List--->629-78-7

629-78-7

629-78-7 Structure

629-78-7 Structure
IdentificationMore
[Name]

N-HEPTADECANE
[CAS]

629-78-7
[Synonyms]

ALKANE C17
HEPTADECANE
N-HEPTADECANE
Normal-heptadecane
Heptadecane,99%
Heptadecane,99.5%
N-HEPTADECANE, 1000MG, NEAT
HEPTADECANE, SUBSTANCE FOR GC
N-HEPTADECANE OEKANAL
#nn-Heptadecane
N-HEPTADECANE, GC STANDARD
HEPTADECANE GC STANDARD
n-Heptadecane,99%
Heptadecane [Standard Material]
[EINECS(EC#)]

211-108-4
[Molecular Formula]

C17H36
[MDL Number]

MFCD00009002
[Molecular Weight]

240.47
[MOL File]

629-78-7.mol
Chemical PropertiesBack Directory
[Appearance]

colourless liquid or white solid
[Melting point ]

20-22 °C(lit.)
[Boiling point ]

302 °C(lit.)
[density ]

0.777 g/mL at 25 °C(lit.)
[vapor density ]

8.3 (vs air)
[vapor pressure ]

1 mm Hg ( 115 °C)
[refractive index ]

n20/D 1.436(lit.)
[Fp ]

300 °F
[storage temp. ]

room temp
[solubility ]

Chloroform (Slightly), Hexane (Slightly)
[form ]

Liquid After Melting
[color ]

Clear colorless
[Specific Gravity]

0.7783
[Stability:]

Stable. Incompatible with strong oxidizing agents. Combustible.
[Water Solubility ]

Immiscible with water.
[FreezingPoint ]

21.0 to 24.0 ℃
[BRN ]

1738898
[Henry's Law Constant]

2.2×10-7 mol/(m3Pa) at 25℃, Hilal et al. (2008)
[Major Application]

petroleum
[Cosmetics Ingredients Functions]

PERFUMING
SKIN CONDITIONING - EMOLLIENT
[InChI]

1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3
[InChIKey]

NDJKXXJCMXVBJW-UHFFFAOYSA-N
[SMILES]

CCCCCCCCCCCCCCCCC
[LogP]

8.69 at 25℃
[Uses]

Combustible.
[CAS DataBase Reference]

629-78-7(CAS DataBase Reference)
[EPA Substance Registry System]

Heptadecane (629-78-7)
Questions And AnswerBack Directory
[thermal conductivity]

n-Heptadecane has a melting point of 21.98 °C, a boiling point of 302.7 °C and a refractive index (n₅₀/D) of 1.4246. The experimental values for thermal conductivity at different pressures and temperatures are as follows[2]:
Experimental Values of Thermal Conductivity  of n- Heptadecane
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)
GHS08
[Signal word ]

Danger
[Hazard statements ]

H304
[Precautionary statements ]

P301+P310-P331-P405-P501
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R65:Harmful: May cause lung damage if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S62:If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[RTECS ]

MI3550000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29011000
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Asp. Tox. 1
[Hazardous Substances Data]

629-78-7(Hazardous Substances Data)
[Toxicity]

mouse,LDLo,intravenous,9821mg/kg (9821mg/kg),BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX),Acta Pharmacologica et Toxicologica. Vol. 37, Pg. 56, 1975.
Raw materials And Preparation ProductsBack Directory
[Raw materials]

STEARYL STEARATE-->Decahydronaphthalene-->Methyl Oleate-->Octadecane-->N-Tetratriacontane-->Methyl stearate
[Preparation Products]

IMINOCTADINE TRIACETATE-->8-Heptadecene-->1-Octadecanol-->Hexane-->Undecane-->ORANILE-->n-Nonane-->2-Methylheptane
Hazard InformationBack Directory
[General Description]

Hexagonal leafs.
[Reactivity Profile]

Saturated aliphatic hydrocarbons, such as N-HEPTADECANE(629-78-7), may be incompatible with strong oxidizing agents like nitric acid. Charring of the hydrocarbon may occur followed by ignition of unreacted hydrocarbon and other nearby combustibles. In other settings, aliphatic saturated hydrocarbons are mostly unreactive. They are not affected by aqueous solutions of acids, alkalis, most oxidizing agents, and most reducing agents. When heated sufficiently or when ignited in the presence of air, oxygen or strong oxidizing agents, they burn exothermically to produce carbon dioxide and water.
[Air & Water Reactions]

Flammable. Insoluble in water.
[Fire Hazard]

Flash point data for this compound is not available,but N-HEPTADECANE is probably combustible.
[Chemical Properties]

colourless liquid or white solid
[Application]

Heptadecane was used as an internal standard in the reaction to study the first direct comparison of kava lactone extraction efficiencies. It was also used as the appropriate suspended solvent for the extraction and concentration of EO (essential oil).
[Definition]

ChEBI: A straight-chain alkane with 17 carbon atoms. It is a component of essential oils from plants like Opuntia littoralis and Annona squamosa.
[Preparation]

Gas-phase dehydrogenation of n-alkanes over noble-metal catalysts yield the corresponding n-alkenes at low conversion rates (ca. 10%) with predominantly internal double bonds. The corresponding alkenes can be isolated in high purity by selective molecular-sieve processes.
[References]

[1] Murata, K., Nishiura, Y., Mitsuoka, S., Horibe, M., Hashimoto, T., Chen, N., Jonoo, Y., Kawabe, S., Nakao, K., & Ishihara, A. (2025). Selective production of a jet fuel fraction through hydrocracking of n-heptadecane using Pt-supported β-zeolite-Al2O3 composite catalysts†. RSC Advances, 29, 23165–23173. https://doi.org/10.1039/D5RA02332G
Spectrum DetailBack Directory
[Spectrum Detail]

N-HEPTADECANE(629-78-7)MS
N-HEPTADECANE(629-78-7)1HNMR
N-HEPTADECANE(629-78-7)13CNMR
N-HEPTADECANE(629-78-7)IR1
N-HEPTADECANE(629-78-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

n-Heptadecane, 99%(629-78-7)
[Alfa Aesar]

n-Heptadecane, 99.5%(629-78-7)
[Sigma Aldrich]

629-78-7(sigmaaldrich)
[TCI AMERICA]

Heptadecane,>99.0%(GC)(629-78-7)
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