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CAS 62452-73-7 1-Ethynyl-4-propylbenzene molecular structure lightbox
CAS RN: 62452-73-7

1-Ethynyl-4-propylbenzene

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260202 100g In stock Shanghai Inquiry
Batchno.20250826 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250505 1g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250306 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250227 500g In stock Shanghai Inquiry
Batchno.20260614 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251227 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-171613
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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: 1ml, 5ml, 10ml, 25ml, 100ml
  • Available purity: >97%
  • Inventory rows with stock: 5
  • 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 62452-73-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1ml >97% 5 In Stock Shenzhen Inquiry
5ml >97% 5 In Stock Shanghai Inquiry
10ml >97% 5 In Stock Hong Kong Inquiry
25ml >97% 3 In Stock Beijing Inquiry
100ml >97% 2 In Stock Shenzhen Inquiry

62452-73-7 / 1-ethynyl-4-propylbenzene

Standard CAS: 62452-73-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
62452-73-7
Multi CAS
No
Molecular Formula
C11H12
Molecular Weight
144.210000
Exact Mass
144.093900
InChI
InChI=1S/C11H12/c1-3-5-11-8-6-10(4-2)7-9-11/h2,6-9H,3,5H2,1H3
InChIKey
UVFFOABHOIMLNB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
2
Molar refractivity
48.37
TPSA
0.0000

LogP / Solubility

WLOGP
2.62
MLOGP
2.3
XLogP3
3.5
Consensus LogP
2.81
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.63
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.01
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)
-1.74

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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