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CAS 3042-81-7 Methyl α-Bromophenylacetate molecular structure lightbox
CAS RN: 3042-81-7

Methyl α-Bromophenylacetate

Product Availability

Choose a grade to view its available package options.

10 package records6 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260505 1g Out of stock Inquiry
Batchno.20260203 25g In stock Inquiry
Batchno.20260122 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260425 100g Out of stock 8-10 business days Inquiry
Batchno.20260513 1g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250625 25g In stock Shanghai Inquiry
Batchno.20250822 5g In stock Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251129 1g Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251129 25g In stock Shanghai Inquiry
Batchno.20250414 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-134844
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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: 10g, 25g, 100g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 3
  • 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 3042-81-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g >97% 5 In Stock Shenzhen Inquiry
25g >97% 5 In Stock Beijing Inquiry
100g >97% 3 In Stock Hong Kong Inquiry
5g >97% 0 Out of Stock Hong Kong Inquiry

3042-81-7 / methyl 2-bromo-2-phenylacetate

Standard CAS: 3042-81-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3042-81-7
Multi CAS
Yes
Molecular Formula
C9H9BRO2
Molecular Weight
229.070000
Exact Mass
227.978590
InChI
InChI=1S/C9H9BrO2/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8H,1H3
InChIKey
NHFBYYMNJUMVOT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
50.13
TPSA
26.3

LogP / Solubility

WLOGP
2.3
MLOGP
2.02
XLogP3
2.6
Consensus LogP
2.31
Log S (ESOL)
-2.94
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.29
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)
-2.49

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
2

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