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1-Chlorooctane

Catalog Number
ACM111853-1
CAS Number
111-85-3
Product Name
1-Chlorooctane
Category
Solubility Enhancing Reagents
Description
Liquid
IUPAC Name
1-chlorooctane
Molecular Weight
148.67g/mol
Molecular Formula
C8H17Cl
Canonical SMILES
CCCCCCCCCl
InChI
InChI=1S/C8H17Cl/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
InChI Key
CNDHHGUSRIZDSL-UHFFFAOYSA-N
Boiling Point
181.5 °C;181.5 °C @ 760 MM HG
Melting Point
-57.8 °C;-57.8 °C
Flash Point
158 °F
Density
0.8738 @ 20 °C/4 °C
Solubility
3.29e-05 M;INSOL IN WATER; VERY SOL IN ALCOHOL, ETHER; SLIGHTLY SOLUBLE IN CARBON TETRACHLORIDE;SOL IN MOST ORG SOLVENTS
Application
1-Chlorooctane is a versatile chemical, primarily recognized for its role in determining excess molar enthalpies in binary mixtures of 2-alkanone and 1-chloroalkane. The compound, a colorless and transparent liquid at ambient temperatures, is widely used in the modification of ω-carrageenans polymers due to its hydrophobic properties. In the chemical and polymer industries, 1-Chlorooctane serves as an alkylating agent in organic synthesis and organometallic compound production. Additionally, it functions as an organic solvent and is used in medicine for worm control. Its application extends into the biosynthesis of monomers for biodegradable polymers, showcasing its potential in developing materials for degradable packaging, tissue engineering, and drug delivery.
Color/Form
COLORLESS LIQUID
Complexity
43.8
Covalently-Bonded Unit Count
1
EC Number
203-915-5
Exact Mass
148.101878g/mol
Formal Charge
0
Hazard Statements
H319
Heat of Vaporization
12.73 kcal/mol at 25 °C
Heavy Atom Count
9
Log P
Log P= 4.73
Monoisotopic Mass
148.101878g/mol
NSC Number
5406
Refractive Index
INDEX OF REFRACTION: 1.4305 @ 20 °C/D
Rotatable Bond Count
6
UNII
E1047328LO
Vapor Pressure
0.95 mmHg;0.95 mm Hg at 25 °C
XLogP3
4.7
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