ChemicalBook--->CAS DataBase List--->6940-76-7

6940-76-7

6940-76-7 Structure

6940-76-7 Structure
IdentificationMore
[Name]

1-CHLORO-3-IODOPROPANE
[CAS]

6940-76-7
[Synonyms]

1-CHLORO-3-IODOPROPANE
3-CHLOROPROPYL IODIDE
TRIMETHYLENE CHLOROIODIDE
1-chloro-3-iodo-propan
1-Chloro-3-iodoproprane
1-CHLORO-3-IODOPROPANE, STAB.
1-Chloro-3-iodopropane,98%
1-Chloro-3-iodopropane, stabilized, 98%
1-CHLORO-3-IODOPROPANE , STABILIZED WITH COPPER
1-Chloro-3-iodopropane, 98%, stab. with copper
1-Chloro-3-iodopropane (stabilized with Copper chip)
1-Iodo-3-chloropropane
[EINECS(EC#)]

230-088-8
[Molecular Formula]

C3H6ClI
[MDL Number]

MFCD00001096
[Molecular Weight]

204.44
[MOL File]

6940-76-7.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR SLIGHTLY YELLOWISH TO LIGHT PINK LIQUID
[Boiling point ]

170-172 °C (lit.)
[density ]

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

6.8 (vs air)
[vapor pressure ]

2 mm Hg ( 20 °C)
[refractive index ]

n20/D 1.548(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

Difficult to mix.
[form ]

Liquid
[color ]

Clear light yellow or light pink to orange
[Specific Gravity]

1.904
[Sensitive ]

Light Sensitive
[BRN ]

1731115
[InChI]

1S/C3H6ClI/c4-2-1-3-5/h1-3H2
[InChIKey]

SFOYQZYQTQDRIY-UHFFFAOYSA-N
[SMILES]

ClCCCI
[CAS DataBase Reference]

6940-76-7(CAS DataBase Reference)
[EPA Substance Registry System]

Propane, 1-chloro-3-iodo- (6940-76-7)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[F ]

8-10
[TSCA ]

Yes
[HS Code ]

29037990
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

CLEAR SLIGHTLY YELLOWISH TO LIGHT PINK LIQUID
[Uses]

1-Chloro-3-iodopropane has been used in the synthesis of N-[4-[5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-2-(2,2,2-trifluoroacetyl)pentyl]benzoyl]-L-glutamic acid, an inhibitor of glycinamide ribonucleotide transformylase (GAR Tfase) and aminoimidazole carboxamide ribonucleotide transformylase (AICAR Tfase), interesting proton sponge type molecule quino[7,8-h]quinoline.
[General Description]

1-Chloro-3-iodopropane undergoes asymmetric α-alkylation with N-sulfinyl imidates to yield 2-substituted N-tert-butanesulfinyl-5-chloropentanimidates. Electroreduction of 1-chloro-3-iodopropane at glassy carbon electrode in dimethylformamide containing tetra-n-butylammonium perchlorate has been investigated by cyclic voltammetry. It also participates in conjugate addition of alkyl iodides to α,β-unsaturated nitriles in water.
Spectrum DetailBack Directory
[Spectrum Detail]

1-CHLORO-3-IODOPROPANE(6940-76-7)MS
1-CHLORO-3-IODOPROPANE(6940-76-7)1HNMR
1-CHLORO-3-IODOPROPANE(6940-76-7)13CNMR
1-CHLORO-3-IODOPROPANE(6940-76-7)IR1
1-CHLORO-3-IODOPROPANE(6940-76-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Chloro-3-iodopropane, stabilized, 98%(6940-76-7)
[Alfa Aesar]

1-Chloro-3-iodopropane, 98%, stab. with copper(6940-76-7)
[Sigma Aldrich]

6940-76-7(sigmaaldrich)
[TCI AMERICA]

1-Chloro-3-iodopropane  (stabilized with Copper chip),>98.0%(GC)(6940-76-7)
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