C46403
3-Chloro-1-propanol
98%
Synonym(s):
1-Chloro-3-hydroxypropane, Trimethylene chlorohydrin
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About This Item
Linear Formula:
Cl(CH2)3OH
CAS Number:
Molecular Weight:
94.54
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
210-992-9
Beilstein/REAXYS Number:
773655
MDL number:
Assay:
98%
Form:
liquid
Quality Level
assay
98%
form
liquid
refractive index
n20/D 1.445 (lit.)
bp
160-162 °C (lit.)
density
1.131 g/mL at 25 °C (lit.)
SMILES string
OCCCCl
InChI
1S/C3H7ClO/c4-2-1-3-5/h5H,1-3H2
InChI key
LAMUXTNQCICZQX-UHFFFAOYSA-N
Application
- Improved Synthesis of Pheromone Components: 3-chloro-1-propanol is used as a linchpin to connect the two synthetic blocks in the synthesis of 6,14-dimethyl-1-octadecene. It is likely used as a reactant in a chemical reaction to facilitate the coupling of the two synthetic blocks, enabling the formation of the desired compound (Taguri et al., 2010).
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
167.0 °F - closed cup
flash_point_c
75 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Hassan M Badawi et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 71(3), 1095-1101 (2008-04-18)
The conformational stability and the three rotor internal rotations in 3-chloro- and 3-bromo-1-propanols were investigated by DFT-B3LYP/6-311+G and ab initio MP2/6-311+G, MP3/6-311+G and MP4(SDTQ)//MP3/6-311+G levels of theory. On the calculated potential energy surface twelve distinct minima were located all of
Muhammad Ameerullah Sahudin et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 248, 119129-119129 (2020-12-08)
Histamine is one of the important biomarkers for food spoilage in the food sectors. In the present study, a rapid and simple analytical tool has been developed to detect histamine as an indirect strategy to monitor food freshness level. Optical
T Yamanaka et al.
The journal of physical chemistry. A, 112(13), 2773-2781 (2008-03-12)
FTIR smog chamber techniques were used to measure k(Cl+n-C3H7OH) = (1.74 +/- 0.15) x 10-10 and k(Cl+CH2ClCH2CH2OH) = (7.54 +/- 0.73) x 10-11 cm3 molecule-1 s-1 in 700 Torr of N2 at 296 K. The reaction of Cl with n-C3H7OH
Global Trade Item Number
| SKU | GTIN |
|---|---|
| C46403-500G | 04061838353139 |
| C46403-100G | 04061838353122 |
| C46403-25G | 04061833492352 |