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CAS 874-60-2 p-Toluoyl Chloride molecular structure lightbox
CAS RN: 874-60-2

p-Toluoyl Chloride

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251024 100g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250522 2.5kg In stock Shandong Inquiry
Batchno.20250916 25g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20260130 500g In stock Shanghai, Shandong, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250201 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-197287
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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: >98%
  • 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 874-60-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g >98% 5 In Stock Shanghai Inquiry
100g >98% 5 In Stock Hong Kong Inquiry
500g >98% 5 In Stock Shenzhen Inquiry

874-60-2 / 4-methylbenzoyl chloride

Standard CAS: 874-60-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
874-60-2
Multi CAS
No
Molecular Formula
C8H7CLO
Molecular Weight
154.590000
Exact Mass
154.018543
InChI
InChI=1S/C8H7ClO/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3
InChIKey
NQUVCRCCRXRJCK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
41.36
TPSA
17.07

LogP / Solubility

WLOGP
2.37
MLOGP
2.08
XLogP3
3.3
Consensus LogP
2.58
Log S (ESOL)
-2.67
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.54
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
Class (SILICOS-IT)
Moderately 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)
-1.98

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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