[email protected]
CAS 109-32-0 8-methylnonyl nonan-1-oate molecular structure lightbox
CAS RN: 109-32-0

8-methylnonyl nonan-1-oate

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250524 1g Out of stock 15 business days Inquiry
  • Product code: SSC-010182
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: 100g
  • 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 109-32-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Shenzhen Inquiry

109-32-0 / 8-methylnonyl nonanoate

ISODECYL PELARGONATE | Nonanoic acid, 8-methylnonyl ester | EINECS 203-665-7

Standard CAS: 109-32-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
109-32-0
Multi CAS
Yes
Molecular Formula
C19H38O2
Molecular Weight
298.500000
Exact Mass
298.287180
SMILES
CCCCCCCCC(=O)OCCCCCCCC(C)C
InChI
InChI=1S/C19H38O2/c1-4-5-6-7-10-13-16-19(20)21-17-14-11-8-9-12-15-18(2)3/h18H,4-17H2,1-3H3
InChIKey
GBLPOPTXAXWWPO-UHFFFAOYSA-N
Synonyms
ISODECYL PELARGONATE Nonanoic acid, 8-methylnonyl ester EINECS 203-665-7 DTXSID3052727 8Methylnonyl nonan1oate

Physical Properties

Physical Description
Clear liquid with a mild ester odor
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
0.95
Rotatable bonds
15
H-bond acceptors
2
Molar refractivity
91.49
TPSA
26.3

LogP / Solubility

WLOGP
6.28
MLOGP
5.54
XLogP3
7.9
Consensus LogP
6.57
Log S (ESOL)
-4.66
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.54
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.61
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
-0.08

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 2 of 2 companies. For more detailed information, please visit ECHA C&L website.

Customers Also Viewed

Get In Touch

Contact Us