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45439

Supelco

1,3-Dichloropropane

PESTANAL®, analytical standard

Synonym(s):

Trimethylene dichloride

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About This Item

Linear Formula:
Cl(CH2)3Cl
CAS Number:
142-28-9
Molecular Weight:
112.99
Beilstein:
505960
EC Number:
205-531-3
MDL number:
MFCD00000999
UNSPSC Code:
41116107
PubChem Substance ID:
329756734

grade

analytical standard

product line

PESTANAL®

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.448 (lit.)

bp

120-122 °C (lit.)

mp

−99 °C (lit.)

density

1.19 g/mL at 25 °C (lit.)

application(s)

agriculture
environmental

format

neat

SMILES string

ClCCCCl

InChI

1S/C3H6Cl2/c4-2-1-3-5/h1-3H2

InChI key

YHRUOJUYPBUZOS-UHFFFAOYSA-N

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Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Warning

Hazard Statements

H226,H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 2

Flash Point(F)

96.8 °F - closed cup

Flash Point(C)

36 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
SZBE164XV
SZBE010XV
SZB9030XV
SZE9030X
3309X

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R Rodriguez-Arnaiz
Environmental and molecular mutagenesis, 31(4), 390-401 (1998-07-08)
Biotransformation of several structurally related 2B compounds to reactive metabolites was evaluated in the somatic w/w+ assay of Drosophila melanogaster. Chemicals tested were the dichlorinated alkanes dichloromethane (DCM), 1,2-dichloroethane (DCE), and 1,3-dichloropropane (DCP); the thiouracil derivatives 5-methyl, 2-thiouracil (5M2TU), 6-methyl
Stefaan De Neve et al.
Journal of environmental quality, 33(5), 1647-1652 (2004-09-10)
The effect of soil fumigation on N mineralization and nitrification needs to be better quantified to optimize N fertilizer advice and predict NO(-)(3) concentrations in crops and NO(-)(3) leaching risks. Seven soils representing a range in soil texture and organic
1,3-Dichloropropene (technical grade).
Report on carcinogens : carcinogen profiles, 10, 91-93 (2004-08-25)
S Shin et al.
Chemico-biological interactions, 97(3), 229-238 (1995-08-18)
Treatment of a lysosome-rich fraction from liver with 2-chloroethylethyl sulfide resulted in a dose-dependent release of arylsulfatase. The inclusion of Ca2+ enhanced the enzyme release by approximately 2.3-fold. The enhancing effect of Ca2+, showing an EC50 value of 30 mM
Daniel J Duffy et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 60(3), 659-671 (2004-01-30)
Ab initio calculations are reported for three of four possible conformers of 1,3-dichloropropane. The fourth conformer, with Cs symmetry, has a predicted enthalpy difference of more than 1500 cm(-1) from the most stable conformer from each calculation regardless of the
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