CAS RN: 1076-26-2
1-METHYL-2-NAPHTHOL
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260518 | 100mg / 250mg / 1g / 5g / 10g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-009100
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
1076-26-2 / 1-methylnaphthalen-2-ol
1-methyl-2-naphthol | 1-Methyl-2-Naphthalenol | 2-Naphthalenol, 1-methyl-
Basic Information
CAS
1076-26-2
Multi CAS
Yes
Molecular Formula
C11H10O
Molecular Weight
158.200000
Exact Mass
158.073165
SMILES
CC1=C(C=CC2=CC=CC=C12)O
InChI
InChI=1S/C11H10O/c1-8-10-5-3-2-4-9(10)6-7-11(8)12/h2-7,12H,1H3
InChIKey
BBOCZFGVXFNCTC-UHFFFAOYSA-N
Synonyms
1-methyl-2-naphthol
1-Methyl-2-Naphthalenol
2-Naphthalenol, 1-methyl-
UNII-DIH495Z3A6
DIH495Z3A6
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
10
Fraction Csp3
0.09
H-bond acceptors
1
H-bond donors
1
Molar refractivity
50.35
TPSA
20.23
LogP / Solubility
WLOGP
2.85
MLOGP
2.51
XLogP3
3.2
Consensus LogP
2.85
Log S (ESOL)
-3.24
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.92
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.06
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)
-1.66
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
