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CAS 20769-85-1 2-Bromoisobutyryl Bromide molecular structure lightbox
CAS RN: 20769-85-1

2-Bromoisobutyryl Bromide

Product Availability

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2 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250119 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260414 25g Out of stock 8-10 business days Inquiry
  • Product code: SSC-097726
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 20769-85-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 5 In Stock Beijing Inquiry
100g ≥98% 5 In Stock Hong Kong Inquiry

20769-85-1 / 2-bromo-2-methylpropanoyl bromide

Standard CAS: 20769-85-1 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
20769-85-1
Multi CAS
No
Molecular Formula
C4H6Br2O
Molecular Weight
229.900000
Exact Mass
229.876490
SMILES
CC(C)(C(=O)Br)Br
InChI
InChI=1S/C4H6Br2O/c1-4(2,6)3(5)7/h1-2H3
InChIKey
YOCIJWAHRAJQFT-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless liquid with an acrid odor
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
36.94
TPSA
17.07

LogP / Solubility

WLOGP
2.08
MLOGP
1.84
XLogP3
2.2
Consensus LogP
2.04
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.95
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
Class (SILICOS-IT)
Poorly 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)
-2.64

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

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