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CAS 65253-31-8 1-Hydroxy-8-chloronaphthalene molecular structure lightbox
CAS RN: 65253-31-8

1-Hydroxy-8-chloronaphthalene

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250412 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS65253-31-8
  • Purity/Analytical Methods: >99.0%
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65253-31-8 / 8-chloronaphthalen-1-ol

Standard CAS: 65253-31-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
65253-31-8
Multi CAS
Yes
Molecular Formula
C10H7CLO
Molecular Weight
178.610000
Exact Mass
178.018543
InChI
InChI=1S/C10H7ClO/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1-6,12H
InChIKey
QVKBELCKHUHPRW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
H-bond acceptors
1
H-bond donors
1
Molar refractivity
50.62
TPSA
20.23

LogP / Solubility

WLOGP
3.2
MLOGP
2.81
XLogP3
3.2
Consensus LogP
3.07
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.33
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.48
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.54

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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