ChemicalBook--->CAS DataBase List--->123-04-6

123-04-6

123-04-6 Structure

123-04-6 Structure
IdentificationMore
[Name]

3-(Chloromethyl)heptane
[CAS]

123-04-6
[Synonyms]

1-CHLORO-2-ETHYLHEXANE
2-ETHYLHEXYL CHLORIDE
3-(CHLOROMETHYL)HEPTANE
TIMTEC-BB SBB005809
3-(chloromethyl)-heptan
3-chloromethyl-heptan
Chloro-iso-octane
Heptane, 3-(chloromethyl)-
hexane,1-chloro-2-ethyl-
3-(Chlormethyl)heptan
3-(CHLOROMETHYL)HEPTANE 98+%
Barchlor(R) 8I
[EINECS(EC#)]

204-594-4
[Molecular Formula]

C8H17Cl
[MDL Number]

MFCD00018940
[Molecular Weight]

148.67
[MOL File]

123-04-6.mol
Chemical PropertiesBack Directory
[Appearance]

Liquid
[Melting point ]

-70 °C
[Boiling point ]

166-168 °C
[density ]

0.882
[vapor pressure ]

1.5hPa at 20℃
[refractive index ]

1.432-1.436
[Fp ]

60 °C
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Liquid
[color ]

Clear yellow
[Water Solubility ]

0.0503 g/L (20 ºC)
[Usage]

Barchlor(R) 8I is used as chemical intermediate.
[Henry's Law Constant]

4.5×10-4 mol/(m3Pa) at 25℃, Hilal et al. (2008)
[InChI]

InChI=1S/C8H17Cl/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
[InChIKey]

WLVCBAMXYMWGLJ-UHFFFAOYSA-N
[SMILES]

CCC(CCl)CCCC
[LogP]

5.6 at 23℃
[CAS DataBase Reference]

123-04-6(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Chloromethyl heptane(123-04-6)
[EPA Substance Registry System]

123-04-6(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Warning
[Hazard statements ]

H226-H315-H319
[Precautionary statements ]

P210-P233-P240-P241+P242+P243-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P370+P378-P403+P235-P501
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

1993
[RTECS ]

MI8760000
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29049095
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2-Ethylhexanol
[Preparation Products]

N-(2-ethylhexyl)propane-1,3-diamine-->2-Ethylhexyllithium
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Isooctylchloride(123-04-6).msds
Hazard InformationBack Directory
[Hazard]

Moderate fire risk.
[Chemical Properties]

Colorless liquid.Insoluble in water. Combustible.
[Uses]

Barchlor(R) 8I is used as chemical intermediate.
[Flammability and Explosibility]

Flammable
Spectrum DetailBack Directory
[Spectrum Detail]

3-(Chloromethyl)heptane(123-04-6)MS
3-(Chloromethyl)heptane(123-04-6)1HNMR
3-(Chloromethyl)heptane(123-04-6)13CNMR
3-(Chloromethyl)heptane(123-04-6)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-(Chloromethyl)heptane, 98+%(123-04-6)
[Sigma Aldrich]

123-04-6(sigmaaldrich)
[TCI AMERICA]

3-(Chloromethyl)heptane,>98.0%(GC)(123-04-6)
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