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CAS 85-56-3 4′-Chlorobenzophenone-2-carboxylic Acid molecular structure lightbox
CAS RN: 85-56-3

4′-Chlorobenzophenone-2-carboxylic Acid

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251231 100g In stock Inquiry
Batchno.20250815 25g In stock Inquiry
Batchno.20260510 500g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250211 25g / 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-192832
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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, 500g
  • 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 85-56-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g >97% 5 In Stock Shenzhen Inquiry
100g >97% 3 In Stock Hong Kong Inquiry
500g >97% 2 In Stock Shenzhen Inquiry

85-56-3 / 2-benzoyl-5-chlorobenzoic acid

Standard CAS: 85-56-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
85-56-3
Multi CAS
Yes
Molecular Formula
C14H9CLO3
Molecular Weight
260.670000
Exact Mass
260.024022
InChI
InChI=1S/C14H9ClO3/c15-10-6-7-11(12(8-10)14(17)18)13(16)9-4-2-1-3-5-9/h1-8H,(H,17,18)
InChIKey
LSVPCSOPJGPTNA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
68.29
TPSA
54.37

LogP / Solubility

WLOGP
3.27
MLOGP
2.88
XLogP3
3.5
Consensus LogP
3.22
Log S (ESOL)
-3.81
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.06
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.43
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.99

Drug-likeness / Medicinal Chemistry

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

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