[email protected]
CAS 18485-38-6 2,4-Dodecadien-1-ol (mixture of stereoisomers) molecular structure lightbox
CAS RN: 18485-38-6

2,4-Dodecadien-1-ol (mixture of stereoisomers)

  • Product code: SSC-085434
GET A QUOTE
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
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 18485-38-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

18485-38-6 / (2E,4E)-dodeca-2,4-dien-1-ol

Standard CAS: 18485-38-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
18485-38-6
Multi CAS
No
Molecular Formula
C12H22O
Molecular Weight
182.300000
Exact Mass
182.167065
SMILES
CCCCCCC/C=C/C=C/CO
InChI
InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h8-11,13H,2-7,12H2,1H3/b9-8+,11-10+
InChIKey
RZDDYVXRTNDWOD-BNFZFUHLSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.67
Rotatable bonds
8
H-bond acceptors
1
H-bond donors
1
Molar refractivity
58.74
TPSA
20.23

LogP / Solubility

WLOGP
3.45
MLOGP
3.04
XLogP3
4.2
Consensus LogP
3.56
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.55
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.67
Class (SILICOS-IT)
Slightly 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)
-1.38

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

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.

Customers Also Viewed

Get In Touch

Contact Us