Bis(4-chlorobutyl) Ether

CAT: 0572-TRC-B418630-1GSize: 1 gDry Ice: NoHazardous: No

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CAT#:0572-TRC-B418630-1GSize:1 g

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CAS Number

6334-96-9

Synonyms

1,1'-Oxybis[4-chlorobutane]; 1,9-Dichloro-5-oxanonane; 4,4'-Dichlorobutyl Ether; 4,4'-Dichlorodibutyl Ether; NSC 26978;

Hazard Statement

No Data Available

Smiles

ClCCCCOCCCCCl

Molecular Formula

C8H16Cl2O

Molecular Weight

199.12

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

Butane, 1,1'-oxybis(4-chloro-

CAS Number	6334-96-9
PubChem CID	22800
IUPAC Name	1-chloro-4-(4-chlorobutoxy)butane
Molecular Formula	C8H16Cl2O
Molecular Weight	199.11
XLogP	2.7
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	8
Heavy Atom Count	11
Formal Charge	0
Complexity	61

SMILES

C(CCCl)COCCCCCl

InChI

InChI=1S/C8H16Cl2O/c9-5-1-3-7-11-8-4-2-6-10/h1-8H2

InChIKey

PVBMXMKIKMJQRK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6334-96-9

CID: 22800

Formula: C8H16Cl2O

MW: 199.11

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	199.11
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	8
Exact Mass	198.0578205
Monoisotopic Mass	198.0578205
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	61.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
MBS6054588-01	Bis(4-chlorobutyl) Ether
GAA33496	Bis (4-chlorobutyl) Ether
B12340-01	Bis (4-Chlorobutyl) ether 98%
sc-232598	4-Chlorobutyl ether
FB152429-01	Bis (4-mercaptophenyl) ether
sc-234042	Bis (4-bromophenyl) ether
OR1012439-01	Bis (4-Chlorosulfonylphenyl) Ether
PC107938	Bis (4-fluorobutyl) ether
PC1261-01	Bis (4-chlorooctafluorobutyl) ether
AR-E10573-01	Bis (4-hydroxybenzyl) ether

Bis(4-chlorobutyl) Ether

Chemical Information

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