ChemicalBook--->CAS DataBase List--->629-62-9

629-62-9

629-62-9 Structure

629-62-9 Structure
IdentificationMore
[Name]

N-PENTADECANE
[CAS]

629-62-9
[Synonyms]

ALKANE C15
N-PENTADECANE
PENTADECANE
PENTADECANE, N-
CH3(CH2)13CH3
PENTADECANE, 99+%
#nn-Pentadecane
N-PENTADECANE MIN. 99,9 %, FOR GAS CHROM ATOGRAPHY
N-PENTADECANE, 1000MG, NEAT
PENTADECANE STANDARD FOR GC
N-PENTADECANE OEKANAL
PENTADECANE 98%
PENTADECANE, n-(SG)
N-PENTADECANE WITH GC
Pentadecane [Standard Material]
[EINECS(EC#)]

211-098-1
[Molecular Formula]

C15H32
[MDL Number]

MFCD00008990
[Molecular Weight]

212.41
[MOL File]

629-62-9.mol
Chemical PropertiesBack Directory
[Appearance]

colourless liquid
[Melting point ]

8-10 °C(lit.)
[Boiling point ]

270 °C(lit.)
[density ]

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

7.4 (vs air)
[vapor pressure ]

1 mm Hg ( 91.6 °C)
[refractive index ]

n20/D 1.431(lit.)
[Fp ]

270 °F
[storage temp. ]

Store below +30°C.
[form ]

Liquid
[color ]

Clear
[Odor]

at 100.00?%. waxy
[Stability:]

Stable. Combustible. Incompatible with strong oxidizing agents.
[explosive limit]

0.45-6.5%(V)
[Water Solubility ]

Immiscible with water.
[BRN ]

1698194
[Henry's Law Constant]

7.8×10-7 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
[Dielectric constant]

2.0499999999999998
[Cosmetics Ingredients Functions]

SOLVENT
[InChI]

1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3
[InChIKey]

YCOZIPAWZNQLMR-UHFFFAOYSA-N
[SMILES]

CCCCCCCCCCCCCCC
[LogP]

8.67 at 25℃
[CAS DataBase Reference]

629-62-9(CAS DataBase Reference)
[EPA Substance Registry System]

Pentadecane (629-62-9)
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
[Risk Statements ]

R66:Repeated exposure may cause skin dryness or cracking.
R65:Harmful: May cause lung damage if swallowed.
[Safety Statements ]

S62:If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label .
[WGK Germany ]

3
[RTECS ]

RZ1800000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29011000
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Asp. Tox. 1
[Hazardous Substances Data]

629-62-9(Hazardous Substances Data)
Hazard InformationBack Directory
[General Description]

Colorless liquid.
[Reactivity Profile]

Saturated aliphatic hydrocarbons, such as N-PENTADECANE(629-62-9), 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]

Insoluble in water.
[Description]

Pentadecane is a component of the larviposition pheromone of the tsetse fly, Glossina morsitans, and 1-pentadecene has been identified from Tribolium beetles. It is primarily used as a solvent in the chemical industry. In addition, it is one of several antifungal volatile compounds produced by the Pseudomonas fradiensis strain BWL1, with a minimum inhibitory concentration (MIC) of 8 g/L.
[Chemical Properties]

colourless liquid
[Uses]

Pentadecane is produced by isolation of n-paraffins (C9–C17) from kerosene and gas oil fractions of crude oil by selective adsorption and fractional distillation. It is used in organic synthesis and as solvent.
[Definition]

ChEBI: A straight-chain alkane with 15 carbon atoms. It is a component of volatile oils isolated from plants species like Scandix balansae.
[Synthesis Reference(s)]

Tetrahedron Letters, 28, p. 2507, 1987 DOI: 10.1016/S0040-4039(00)95453-4
[Synthesis]

Pentadecane was synthesised using hexadecanoic acid as the starting material, under the catalysis of a Ni4Fe1 alloy, with dodecane as the solvent, at 220 °C and a hydrogen pressure of 2 MPa, over a reaction time of 4 hours. In this process, the hydrogenation of hexadecanoic acid first occurs to form the intermediate hexadecanol. Subsequently, this intermediate undergoes a decarboxylation reaction on the surface of the Ni₄Fe₁ catalyst, releasing one molecule of CO, thereby synthesising pentadecane with high selectivity. The yield is 98%[1].
[References]

[1] Wang, L., Yang, Y., Song, S., Shi, Y., Da, W., Tian, Z., Deng, Y., Zhang, M., Zhang, X., Zheng, L., Tan, T., Wei, M. (2025). Switchable Product Selectivity in Biodiesel Synthesis. ACS Catalysis , 39 1. https://doi.org/10.1021/acscatal.4c08096
Spectrum DetailBack Directory
[Spectrum Detail]

N-PENTADECANE(629-62-9)MS
N-PENTADECANE(629-62-9)1HNMR
N-PENTADECANE(629-62-9)13CNMR
N-PENTADECANE(629-62-9)IR1
N-PENTADECANE(629-62-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

n-Pentadecane, 99%(629-62-9)
[Alfa Aesar]

n-Pentadecane, 99%(629-62-9)
[Sigma Aldrich]

629-62-9(sigmaaldrich)
[TCI AMERICA]

Pentadecane,>99.0%(GC)(629-62-9)
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