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CAS 112-29-8 1-Bromodecane molecular structure lightbox
CAS RN: 112-29-8

1-Bromodecane

Product Availability

Choose a grade to view its available package options.

6 package records4 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250822 100g In stock Inquiry
Batchno.20251010 2.5kg Out of stock Inquiry
Batchno.20250808 25g In stock Inquiry
Batchno.20250207 500g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260515 25ml / 100ml / 500ml / 2.5L / 12X500ml Confirm by inquiry Shanghai, Shandong, Chongqing 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251003 25ml Out of stock 8-10 business days Inquiry
  • Product code: SSC-012476
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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: 100g, 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 112-29-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Shanghai Inquiry
500g ≥97% 0 Out of Stock Beijing Inquiry

112-29-8 / 1-bromodecane

1-BROMODECANE | Decyl bromide | n-Decyl bromide

Standard CAS: 112-29-8 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
112-29-8
Multi CAS
Yes
Molecular Formula
C10H21Br
Molecular Weight
221.180000
Exact Mass
220.082660
SMILES
CCCCCCCCCCBr
InChI
InChI=1S/C10H21Br/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
MYMSJFSOOQERIO-UHFFFAOYSA-N
Synonyms
1-BROMODECANE Decyl bromide n-Decyl bromide Decane, 1-bromo- 1-Decyl bromide

Physical Properties

Physical Description
Liquid Clear, light yellow liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
8
Molar refractivity
56.4
TPSA
0.0000

LogP / Solubility

WLOGP
4.52
MLOGP
3.98
XLogP3
6
Consensus LogP
4.83
Log S (ESOL)
-3.53
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.64
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.81
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)
-0.86

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 Environmental Hazard
Signal
Warning
GHS Hazard Statements
H315 (15.1%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (15.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H400 (83%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410 (11.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501

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