[email protected]
CAS 211737-28-9 2-Bromo-5-hexylthiophene molecular structure lightbox
CAS RN: 211737-28-9

2-Bromo-5-hexylthiophene

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260402 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-101155
GET A QUOTE
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: 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 211737-28-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Hong Kong Inquiry

211737-28-9 / 2-bromo-5-hexylthiophene

Standard CAS: 211737-28-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
211737-28-9
Multi CAS
No
Molecular Formula
C10H15BrS
Molecular Weight
247.200000
Exact Mass
246.007780
SMILES
CCCCCCC1=CC=C(S1)Br
InChI
InChI=1S/C10H15BrS/c1-2-3-4-5-6-9-7-8-10(11)12-9/h7-8H,2-6H2,1H3
InChIKey
LSIYDKGTGHFTFW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
5
Fraction Csp3
0.6
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
59.87
TPSA
28.2000

LogP / Solubility

WLOGP
4.63
MLOGP
4.08
XLogP3
5.4
Consensus LogP
4.7
Log S (ESOL)
-4.27
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.71
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)
-0.94

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us