[email protected]
CAS 10203-33-5 5-DODECANOL molecular structure lightbox
CAS RN: 10203-33-5

5-DODECANOL

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250730 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS10203-33-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

10203-33-5 / dodecan-5-ol

5-DODECANOL | Dodecan-5-ol | 5-hydroxydodecane

Standard CAS: 10203-33-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
10203-33-5
Multi CAS
No
Molecular Formula
C12H26O
Molecular Weight
186.330000
Exact Mass
186.198365
SMILES
CCCCCCCC(CCCC)O
InChI
InChI=1S/C12H26O/c1-3-5-7-8-9-11-12(13)10-6-4-2/h12-13H,3-11H2,1-2H3
InChIKey
AVERNHDYEFYHIV-UHFFFAOYSA-N
Synonyms
5-DODECANOL Dodecan-5-ol 5-hydroxydodecane EINECS 233-503-0 NSC158520

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
58.91
TPSA
20.23

LogP / Solubility

WLOGP
3.9
MLOGP
3.43
XLogP3
4.8
Consensus LogP
4.04
Log S (ESOL)
-2.86
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.9
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.19
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.09

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
2

Customers Also Viewed

Get In Touch

Contact Us