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Key Documents

C46403

Sigma-Aldrich

3-Chloro-1-propanol

98%

Synonyma:

1-Chloro-3-hydroxypropane, Trimethylene chlorohydrin

Přihlásitk zobrazení cen stanovených pro organizaci a smluvních cen


About This Item

Lineární vzorec:
Cl(CH2)3OH
Číslo CAS:
Molekulová hmotnost:
94.54
Beilstein/REAXYS Number:
773655
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

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

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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).

pictograms

Exclamation mark

signalword

Warning

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_germany

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


Osvědčení o analýze (COA)

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A R Jones
Reproduction, fertility, and development, 9(6), 577-581 (1997-01-01)
Boar sperm rapidly interconverted dihydroxyacetone phosphate and glyceraldehyde 3-phosphate, produced fructose-1,6-bisphosphate, approximately equilibrium concentrations of fructose 6-phosphate and glucose 6-phosphate but not glycerol or glycerol 3-phosphate. In the presence of 3-chloro-1-hydroxypropanone, an inhibitor of stage 2 of the glycolytic pathway
A R Jones et al.
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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
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