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CAS 627-90-7 Ethyl Undecanoate molecular structure lightbox
CAS RN: 627-90-7

Ethyl Undecanoate

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260626 100g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250919 10g In stock Shanghai, Tianjin Inquiry
Batchno.20250909 1kg Out of stock Inquiry
Batchno.20250805 25g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250510 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-171988
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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: >98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 627-90-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g >98% 0 Out of Stock Shanghai Inquiry

627-90-7 / ethyl undecanoate

Standard CAS: 627-90-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
627-90-7
Multi CAS
Yes
Molecular Formula
C13H26O2
Molecular Weight
214.340000
Exact Mass
214.193280
InChI
InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3-12H2,1-2H3
InChIKey
IAFQYUQIAOWKSB-UHFFFAOYSA-N

Physical Properties

Melting Point
-15 °C
Boiling Point
105.00 °C. @ 4.00 mm Hg
Density
0.87
Physical Description
Liquid Colourless liquid with a wine-like, fatty/fruity, somewhat nutty odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.92
Rotatable bonds
10
H-bond acceptors
2
Molar refractivity
63.86
TPSA
26.3

LogP / Solubility

WLOGP
4.08
MLOGP
3.59
XLogP3
5.1
Consensus LogP
4.26
Log S (ESOL)
-3.08
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.26
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.64
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)
-1.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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