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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

Quality Level

100

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

WGK

WGK 1

Flash Point(F)

closed cup

Flash Point(C)

closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

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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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)
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)
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)
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)

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