[email protected]
CAS 14944-28-6 1-Methyl-1,2,3,4-tetrahydronaphthalen-1-ol molecular structure lightbox
CAS RN: 14944-28-6

1-Methyl-1,2,3,4-tetrahydronaphthalen-1-ol

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260302 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: LINM905511
GET A QUOTE

14944-28-6 / 1-methyl-3,4-dihydro-2H-naphthalen-1-ol

Standard CAS: 14944-28-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14944-28-6
Multi CAS
No
Molecular Formula
C11H14O
Molecular Weight
162.230000
Exact Mass
162.104465
SMILES
CC1(CCCC2=CC=CC=C21)O
InChI
InChI=1S/C11H14O/c1-11(12)8-4-6-9-5-2-3-7-10(9)11/h2-3,5,7,12H,4,6,8H2,1H3
InChIKey
HAQPAIYNBOCMTO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.45
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.95
TPSA
20.23

LogP / Solubility

WLOGP
2.23
MLOGP
1.96
XLogP3
2
Consensus LogP
2.06
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.5
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.57
Class (SILICOS-IT)
Moderately 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)
-2.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Customers Also Viewed

Get In Touch

Contact Us