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D59100

Sigma-Aldrich

1,4-Dichlorobutane

99%

Synonym(s):

Tetramethylene dichloride

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About This Item

Linear Formula:
Cl(CH2)4Cl
CAS Number:
110-56-5
Molecular Weight:
127.01
Beilstein:
635673
EC Number:
203-778-1
MDL number:
MFCD00001011
UNSPSC Code:
12352100
PubChem Substance ID:
24893983
NACRES:
NA.22

Assay

99%

form

liquid

refractive index

n20/D 1.454 (lit.)

bp

161-163 °C (lit.)

mp

−38 °C (lit.)

density

1.16 g/mL at 25 °C (lit.)

SMILES string

ClCCCCCl

InChI

1S/C4H8Cl2/c5-3-1-2-4-6/h1-4H2

InChI key

KJDRSWPQXHESDQ-UHFFFAOYSA-N

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Application

1,4-Dichlorobutane is extensively used in the synthesis of a variety of ligands, including commonly used 1,1′-(1,4-butanediyl)bis(imidazole) (bbi), to prepare coordination polymers and metal-organic frameworks (MOFs). It can also be used a reagent in the synthesis of natural products such as spiro[4.5]-δ-damascone.

Pictograms

Flame
GHS02

Signal Word

Warning

Hazard Statements

H226,H412

Hazard Classifications

Aquatic Chronic 3 - Flam. Liq. 3

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

104.0 °F - closed cup

Flash Point(C)

40 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Four new coordination polymers of Cu (II) with 1, 1?-(1, 4-butanediyl) bis (imidazole).
Ma JF, et al.
Polyhedron, 23(4), 553-559 (2004)
Structures of metal-organic networks based on flexible 1, 1?-(1, 4-butanediyl) bis (imidazole-2-phenyl) ligand.
Liu YY, et al.
CrystEngComm, 10(5), 565-572 (2008)
Synthesis and Olfactory Properties of a 6??Silasubstituted ?Spiro [4.5]?δ?Damascone?.
Lovchik M A and Kraft P
Chemistry?A European Journal , 23(19), 4590-4596 (2017)
A porous supramolecular architecture from a copper (II) coordination polymer with a 3D four-connected 86 net.
Ma JF, et al.
Inorganic Chemistry, 42(23), 7531-7534 (2003)

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