[email protected]
CAS 76008-73-6 Ethyl 5-Bromo-2-chlorobenzoate molecular structure lightbox
CAS RN: 76008-73-6

Ethyl 5-Bromo-2-chlorobenzoate

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251213 100g In stock Inquiry
Batchno.20250728 1g In stock Inquiry
Batchno.20250502 25g In stock Inquiry
Batchno.20250727 5g In stock Inquiry
  • Product code: SSC-185462
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, 100g
  • 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 76008-73-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Hong Kong Inquiry
100g ＞97% 0 Out of Stock Shanghai Inquiry

76008-73-6 / ethyl 5-bromo-2-chlorobenzoate

Standard CAS: 76008-73-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
76008-73-6
Multi CAS
Yes
Molecular Formula
C9H8BRCLO2
Molecular Weight
263.510000
Exact Mass
261.939620
InChI
InChI=1S/C9H8BrClO2/c1-2-13-9(12)7-5-6(10)3-4-8(7)11/h3-5H,2H2,1H3
InChIKey
AMGWDYLEMSMUIO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
55.11
TPSA
26.3

LogP / Solubility

WLOGP
3.28
MLOGP
2.89
XLogP3
3.8
Consensus LogP
3.32
Log S (ESOL)
-3.75
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.09
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.33
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us