CAS RN: 109055-42-7
9-AMINO-1-NONANOL
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock2 grade groups
- Product code: SSC-010221
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: ≥95%
- 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 | ≥95% | 0 Out of Stock | Beijing | Inquiry |
109055-42-7 / 9-aminononan-1-ol
9-aminononan-1-ol | DTXSID10599955 | RefChem:312941
Basic Information
CAS
109055-42-7
Multi CAS
No
Molecular Formula
C9H21NO
Molecular Weight
159.270000
Exact Mass
159.162314
SMILES
C(CCCCN)CCCCO
InChI
InChI=1S/C9H21NO/c10-8-6-4-2-1-3-5-7-9-11/h11H,1-10H2
InChIKey
NLAPHXHHULDDRT-UHFFFAOYSA-N
Synonyms
9-aminononan-1-ol
DTXSID10599955
RefChem:312941
DTXCID60550713
9-AMINO-1-NONANOL
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.46
TPSA
46.25
LogP / Solubility
WLOGP
1.67
MLOGP
1.46
XLogP3
1.7
Consensus LogP
1.61
Log S (ESOL)
-1.35
Class (ESOL)
Soluble
Log S (Ali)
-2.07
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.04
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)
-2.51
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
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