ChemicalBook--->CAS DataBase List--->629-06-1

629-06-1

629-06-1 Structure

629-06-1 Structure
IdentificationMore
[Name]

1-Chloroheptane
[CAS]

629-06-1
[Synonyms]

1-CHLOROHEPTANE
HEPTYL CHLORIDE
N-HEPTYL CHLORIDE
1-Chloroheptane,97%
[EINECS(EC#)]

211-070-9
[Molecular Formula]

C7H15Cl
[MDL Number]

MFCD00001021
[Molecular Weight]

134.65
[MOL File]

629-06-1.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS LIQUID
[Melting point ]

-69 °C (lit.)
[Boiling point ]

159-161 °C (lit.)
[density ]

0.881 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.425(lit.)
[Fp ]

107 °F
[storage temp. ]

Flammables area
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Water Solubility ]

Insoluble
[BRN ]

1697159
[Dielectric constant]

5.4800000000000004
[InChI]

1S/C7H15Cl/c1-2-3-4-5-6-7-8/h2-7H2,1H3
[InChIKey]

DZMDPHNGKBEVRE-UHFFFAOYSA-N
[SMILES]

CCCCCCCCl
[CAS DataBase Reference]

629-06-1(CAS DataBase Reference)
[NIST Chemistry Reference]

Heptane, 1-chloro-(629-06-1)
[EPA Substance Registry System]

629-06-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi,N
[Risk Statements ]

R10:Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin .
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29031990
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 3
Hazard InformationBack Directory
[General Description]

Colorless liquid. Insoluble in water.
[Reactivity Profile]

1-CHLOROHEPTANE(629-06-1) may be incompatible with strong oxidizing and reducing agents. Also may be incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.
[Air & Water Reactions]

Highly flammable. Vapors may form explosive mixtures with air. Insoluble in water.
[Chemical Properties]

CLEAR COLOURLESS LIQUID
[Uses]

1-Chloroheptane was used in the coupling of a GC to the ICP-MHMS-FPC for the determination of halogenated hydrocarbons and organometallic species.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 48, p. 2625, 1983 DOI: 10.1021/jo00163a047
Spectrum DetailBack Directory
[Spectrum Detail]

1-Chloroheptane(629-06-1)MS
1-Chloroheptane(629-06-1)1HNMR
1-Chloroheptane(629-06-1)13CNMR
1-Chloroheptane(629-06-1)IR1
1-Chloroheptane(629-06-1)IR2
1-Chloroheptane(629-06-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Chloroheptane, 97%(629-06-1)
[Alfa Aesar]

1-Chloroheptane, 97%(629-06-1)
[Sigma Aldrich]

629-06-1(sigmaaldrich)
[TCI AMERICA]

1-Chloroheptane,>99.0%(GC)(629-06-1)
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