234478
1-Chloro-3-iodopropane
99%
Synonym(s):
Trimethylene chloroiodide
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About This Item
Linear Formula:
Cl(CH2)3I
CAS Number:
Molecular Weight:
204.44
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
230-088-8
Beilstein/REAXYS Number:
1731115
MDL number:
Assay:
99%
Form:
liquid
vapor density
6.8 (vs air)
Quality Segment
vapor pressure
2 mmHg ( 20 °C)
assay
99%
form
liquid
contains
copper as stabilizer
refractive index
n
bp
170-172 °C (lit.)
density
1.904 g/mL at 25 °C (lit.)
functional group
chloro, iodo
SMILES string
ClCCCI
InChI
1S/C3H6ClI/c4-2-1-3-5/h1-3H2
InChI key
SFOYQZYQTQDRIY-UHFFFAOYSA-N
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.
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
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
230.0 °F - closed cup
flash_point_c
110 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
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