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
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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
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
T G Cooper et al.
International journal of andrology, 23(4), 243-247 (2000-07-25)
3-(36)Chloro-1-hydroxypropanone (CHOP), a specific inhibitor of sperm glycolysis in vitro, is rapidly metabolized by the male rat to alpha-chlorohydrin, 3-chlorolactate and the inhibitory sperm metabolite, 3-chlorolactaldehyde, presumably all being of the (S)-configuration. The dimethyl ketal of (36)Cl-CHOP [3-(36)Cl-dimethyl-CHOP] is rapidly