Products Categories
| CAS No.: | 111-85-3 |
|---|---|
| Name: | 1-Chlorooctane |
| Article Data: | 145 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H17Cl |
| Molecular Weight: | 148.676 |
| Synonyms: | 1-Octyl chloride;Capryl chloride;NSC 5406;Octyl chloride;n-Octyl chloride;n-Octyl chlorid; |
| EINECS: | 203-915-5 |
| Density: | 0.864 g/cm3 |
| Melting Point: | -61 °C(lit.) |
| Boiling Point: | 181.9 °C at 760 mmHg |
| Flash Point: | 57.8 °C |
| Solubility: | 0.02 g/L in water |
| Appearance: | Liquid |
| Hazard Symbols: |
 N
|
| Risk Codes: | 52/53 |
| Safety: | 23-24/25-61 |
| Transport Information: | UN 1993 3/PG 3 |
| PSA: | 0.00000 |
| LogP: | 3.58570 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 1219080-61-1IMIDAZOLE-2-BORONIC ACID
What can I do for you?
Get Best Price
Specification
The Octane, 1-chloro- is an organic compound with the formula C8H17Cl. The IUPAC name of this chemical is 1-chlorooctane. With the CAS registry number 111-85-3, it is also named as 2-Octyl chloride. The product's categories are Alkyl Chlorides; Monofunctional & alpha, omega-Bifunctional Alkanes; Monofunctional Alkanes. Besides, it should be stored in a cool and dry place. It is used as chemical intermediate.
Physical properties about Octane, 1-chloro- are: (1)ACD/LogP: 4.69; (2)ACD/LogD (pH 5.5): 4.69; (3)ACD/LogD (pH 7.4): 4.69; (4)ACD/BCF (pH 5.5): 2154.55; (5)ACD/BCF (pH 7.4): 2154.55; (6)ACD/KOC (pH 5.5): 8464.74; (7)ACD/KOC (pH 7.4): 8464.74; (8)#Freely Rotating Bonds: 6; (9)Index of Refraction: 1.424; (10)Molar Refractivity: 43.96 cm3; (11)Molar Volume: 171.9 cm3; (12)Polarizability: 17.42×10-24cm3; (13)Surface Tension: 26.1 dyne/cm; (14)Density: 0.864 g/cm3; (15)Flash Point: 57.8 °C; (16)Enthalpy of Vaporization: 40.1 kJ/mol; (17)Boiling Point: 181.9 °C at 760 mmHg; (18)Vapour Pressure: 1.13 mmHg at 25°C.
Preparation: this chemical can be prepared by 1-fluoro-octane. This reaction will need reagent aq. HCl, hexadecyltributylphosphonium bromide. The reaction time is 80 hours with reaction temperature of 130 °C. The yield is about 81%.
.gif)
Uses of Octane, 1-chloro-: it can be used to produce 1-iodo-octane at temperature of 135 °C. It will need reagent pentanediol-(1.2), pentanediol-(1.5) and KI.
.gif)
When you are using this chemical, please be cautious about it as the following:
It is harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. When you are using it, do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer), avoid contact with skin and eyes and avoid release to the environment. Refer to special instructions/safety data sheet.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCCCCCCCCCopy
(2)InChI: InChI=1/C8H17Cl/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
(3)InChIKey: CNDHHGUSRIZDSL-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H17Cl/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
(5)Std. InChIKey: CNDHHGUSRIZDSL-UHFFFAOYSA-N
-
Premium Related Products
