[email protected]
CAS 36288-21-8 Chrysene, 3-chloro- molecular structure lightbox
CAS RN: 36288-21-8

Chrysene, 3-chloro-

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260417 100g In stock Shanghai Inquiry
Batchno.20250311 1g In stock Shanghai Inquiry
Batchno.20260512 250mg In stock Shanghai Inquiry
Batchno.20250727 25g In stock Shanghai Inquiry
Batchno.20250227 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS36288-21-8
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

36288-21-8 / 3-chlorochrysene

Standard CAS: 36288-21-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
36288-21-8
Multi CAS
No
Molecular Formula
C18H11CL
Molecular Weight
262.700000
Exact Mass
262.054928
InChI
InChI=1S/C18H11Cl/c19-14-8-5-13-7-9-16-15-4-2-1-3-12(15)6-10-17(16)18(13)11-14/h1-11H
InChIKey
GLWRUZZCCWGEMX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
18
Molar refractivity
83.97
TPSA
0.0000

LogP / Solubility

WLOGP
5.8
MLOGP
5.11
XLogP3
6.6
Consensus LogP
5.84
Log S (ESOL)
-5.82
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.9
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.18
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.2

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
2

Customers Also Viewed

Get In Touch

Contact Us