1-Chloro-3-iodopropane

ALDRICH/234478 - 99%

Synonym: Trimethylene chloroiodide

CAS Number: 6940-76-7
Empirical Formula (Hill Notation): C₃H₆ClI
Molecular Weight: 204.44
EC Number: 230-088-8
MDL Number: MFCD00001096
Linear Formula: Cl(CH₂)₃I
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-234478-25G	25 g	$72.80 1/EA		Add To Favorites
45-234478-100G	100 g	$190.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	99%
bp	170-172 °C (lit.)
contains	copper as stabilizer
density	1.904 g/mL at 25 °C (lit.)
form	liquid
InChI	1S/C3H6ClI/c4-2-1-3-5/h1-3H2
InChI key	SFOYQZYQTQDRIY-UHFFFAOYSA-N
Quality Level	100
refractive index	n20/D 1.548 (lit.)
SMILES string	ClCCCI
vapor density	6.8 (vs air)
vapor pressure	2 mmHg ( 20 °C)

Application:	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.
Packaging:	25, 100 g in glass bottle

Symbol	GHS07
Signal word	Warning
Hazard statements	H315 - H319 - H335
Precautionary statements	P302 + P352 - P305 + P351 + P338
Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26-36
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	230.0 °F - closed cup
Flash Point(C)	110 °C - closed cup

Purity	99%
bp	170-172 °C (lit.)
Density	1.904 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.548 (lit.)
UNSPSC	12352100

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