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CAS 74925-46-5 2-Chloro-3-phenylnaphthalene molecular structure lightbox
CAS RN: 74925-46-5

2-Chloro-3-phenylnaphthalene

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250801 100mg / 250mg / 1g / 5g / 10g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS74925-46-5
  • Purity/Analytical Methods: >99.0%
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74925-46-5 / 2-chloro-3-phenylnaphthalene

Standard CAS: 74925-46-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
74925-46-5
Multi CAS
No
Molecular Formula
C16H11CL
Molecular Weight
238.710000
Exact Mass
238.054928
InChI
InChI=1S/C16H11Cl/c17-16-11-14-9-5-4-8-13(14)10-15(16)12-6-2-1-3-7-12/h1-11H
InChIKey
NJBQVBBSCVZPHZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
16
Rotatable bonds
1
Molar refractivity
74.39
TPSA
0.0000

LogP / Solubility

WLOGP
5.16
MLOGP
4.55
XLogP3
5.4
Consensus LogP
5.04
Log S (ESOL)
-5.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.61
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-0.51

Drug-likeness / Medicinal Chemistry

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

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