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CAS 112-52-7 1-Chlorododecane molecular structure lightbox
CAS RN: 112-52-7

1-Chlorododecane

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250825 100ml / 500ml / 5L / 20L / 12X500ml Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
  • Product code: SSC-012494
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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: 500g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 112-52-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ＞97% 0 Out of Stock Shenzhen Inquiry

112-52-7 / 1-chlorododecane

1-CHLORODODECANE | Lauryl chloride | Dodecyl chloride

Standard CAS: 112-52-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
112-52-7
Multi CAS
No
Molecular Formula
C12H25Cl
Molecular Weight
204.780000
Exact Mass
204.164479
SMILES
CCCCCCCCCCCCCl
InChI
InChI=1S/C12H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3
InChIKey
YAYNEUUHHLGGAH-UHFFFAOYSA-N
Synonyms
1-CHLORODODECANE Lauryl chloride Dodecyl chloride laurylchloride n-Dodecyl chloride

Physical Properties

Melting Point
15.3 °F (NTP, 1992)
Boiling Point
500 °F at 760 mmHg (NTP, 1992)
Density
0.8687 at 68 °F (NTP, 1992) - Less dense than water; will float
Physical Description
Lauryl chloride is a clear colorless oily liquid. (NTP, 1992) Liquid Colorless oily liquid; [CAMEO]
State
Liquid
Storage Conditions
STORAGE PRECAUTIONS: You should store this material in a refrigerator. STORE AWAY FROM SOURCES OF IGNITION. (NTP, 1992)

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
10
Molar refractivity
62.56
TPSA
0.0000

LogP / Solubility

WLOGP
5.15
MLOGP
4.53
XLogP3
6.9
Consensus LogP
5.53
Log S (ESOL)
-3.69
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.95
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.46
Class (SILICOS-IT)
Insoluble

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)
-0.32

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)
Irritant Health Hazard Environmental Hazard
Signal
Warning
GHS Hazard Statements
H315 (20.4%): Causes skin irritation [Warning Skin corrosion/irritation] H351 (79.6%): Suspected of causing cancer [Warning Carcinogenicity] H400 (98%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410 (98%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P203, P264, P273, P280, P302+P352, P318, P321, P332+P317, P362+P364, P391, P405, and P501

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