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CAS 83811-73-8 (4-PHENYLCYCLOHEXYL)METHANOL molecular structure lightbox
CAS RN: 83811-73-8

(4-PHENYLCYCLOHEXYL)METHANOL

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250305 25mg / 100mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS83811-73-8
  • Purity/Analytical Methods: >99.0%
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83811-73-8 / (4-phenylcyclohexyl)methanol

Standard CAS: 83811-73-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
83811-73-8
Multi CAS
No
Molecular Formula
C13H18O
Molecular Weight
190.280000
Exact Mass
190.135765
InChI
InChI=1S/C13H18O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-5,11,13-14H,6-10H2
InChIKey
SRPDEHMURXAMGW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.54
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
58.23
TPSA
20.23

LogP / Solubility

WLOGP
2.95
MLOGP
2.6
XLogP3
3.1
Consensus LogP
2.88
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.25
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.59
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)
-1.78

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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