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CAS 37688-96-3 1,14-DIBROMOTETRADECANE molecular structure lightbox
CAS RN: 37688-96-3

1,14-DIBROMOTETRADECANE

  • Product code: SSC-145129
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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: 5g
  • 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 37688-96-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

37688-96-3 / 1,14-dibromotetradecane

Standard CAS: 37688-96-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
37688-96-3
Multi CAS
Yes
Molecular Formula
C14H28BR2
Molecular Weight
356.180000
Exact Mass
356.053730
InChI
InChI=1S/C14H28Br2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h1-14H2
InChIKey
SDENLXLNLFKRAR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
1
Rotatable bonds
13
Molar refractivity
82.99
TPSA
0.0000

LogP / Solubility

WLOGP
6.46
MLOGP
5.7
XLogP3
7.5
Consensus LogP
6.55
Log S (ESOL)
-5.26
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.14
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.89
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.31

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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