CAS RN: 52019-78-0
(S)-(+)-2-Hexanol
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.20250804 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-159080
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 |
52019-78-0 / hexan-1-ol
Basic Information
CAS
52019-78-0
Multi CAS
Yes
Molecular Formula
C6H14O
Molecular Weight
102.170000
Exact Mass
102.104465
InChI
InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3/t6-/m0/s1
InChIKey
QNVRIHYSUZMSGM-LURJTMIESA-N
Physical Properties
Melting Point
-48.3 °F (USCG, 1999)
-44.6 °C
Boiling Point
314.8 °F at 760 mmHg (USCG, 1999)
157 °C at 760 mm Hg
Boiling points at various pressures. [Table#1649]
156.00 to 157.00 °C. @ 760.00 mm Hg
157 °C
Density
0.85 at 68 °F (USCG, 1999) - Less dense than water; will float
0.8153 at 25 °C/4 °C; 0.8082 at 35 °C/4 °C
Bulk density = 6.8 lb/gal
Relative density (water = 1): 0.82
0.816-0.821
Physical Description
Hexanols appears as a clear colorless liquid mixture of isomeric six-carbon alcohols with similar chemical properties. Vapors are heavier than air. Used to make pharmaceuticals and as a solvent.
N-hexanol appears as a clear colorless liquid. Flash point 149 °F. Less dense than water and insoluble in water. Vapors heavier than air.
Liquid
Colorless liquid with a fruity odor; [CHEMINFO]
COLOURLESS LIQUID WITH CHARACTERISTIC ODOUR.
Appearance
Colorless liquid
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
1
H-bond donors
1
Molar refractivity
31.23
TPSA
20.23
LogP / Solubility
WLOGP
1.56
MLOGP
1.36
XLogP3
2
Consensus LogP
1.64
Log S (ESOL)
-1.19
Class (ESOL)
Soluble
Log S (Ali)
-1.52
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.1
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)
-2.24
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
