CAS RN: 1002-69-3
1-Chlorodecane
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260402 | 1ml / 25ml / 100ml / 500ml / 2.5L / 10L | Confirm by inquiry | Shanghai, Shandong, Guangdong | Inquiry |
- Product code: SSC-000629
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 100g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 100g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
1002-69-3 / 1-chlorodecane
1-CHLORODECANE | Decyl chloride | Decane, 1-chloro-
Basic Information
CAS
1002-69-3
Multi CAS
Yes
Molecular Formula
C10H21Cl
Molecular Weight
176.720000
Exact Mass
176.133178
SMILES
CCCCCCCCCCCl
InChI
InChI=1S/C10H21Cl/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
ZTEHOZMYMCEYRM-UHFFFAOYSA-N
Synonyms
1-CHLORODECANE
Decyl chloride
Decane, 1-chloro-
n-Decyl chloride
L0HSC44E5X
Physical Properties
Physical Description
Liquid
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
8
Molar refractivity
53.33
TPSA
0.0000
LogP / Solubility
WLOGP
4.37
MLOGP
3.84
XLogP3
5.8
Consensus LogP
4.67
Log S (ESOL)
-3.16
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.39
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.7
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Health Hazard
Environmental Hazard
Signal
Warning
GHS Hazard Statements
H351 (88.4%): Suspected of causing cancer [Warning Carcinogenicity]
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P203, P273, P280, P318, P391, P405, and P501
