CAS RN: 2156-96-9
DECYL ACRYLATE
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-103348
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 |
2156-96-9 / decyl prop-2-enoate
Basic Information
CAS
2156-96-9
Multi CAS
No
Molecular Formula
C13H24O2
Molecular Weight
212.330000
Exact Mass
212.177630
SMILES
CCCCCCCCCCOC(=O)C=C
InChI
InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-15-13(14)4-2/h4H,2-3,5-12H2,1H3
InChIKey
FWLDHHJLVGRRHD-UHFFFAOYSA-N
Physical Properties
Melting Point
less than 32 °F (USCG, 1999)
not available
Boiling Point
473 °F at 760 mmHg (est.) (USCG, 1999)
158 °C @ 50 MM HG
Density
0.8781 at 68 °F (USCG, 1999) - Less dense than water; will float
0.8781 at 20 °C/4 °C
Relative density (water = 1): 0.88
Physical Description
N-decyl acrylate is a liquid. Less dense than water and insoluble in water. Hence floats on water. (USCG, 1999)
Liquid
Liquid; [ICSC]
LIQUID.
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.77
Rotatable bonds
10
H-bond acceptors
2
Molar refractivity
63.77
TPSA
26.3
LogP / Solubility
WLOGP
3.86
MLOGP
3.4
XLogP3
5.1
Consensus LogP
4.12
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.09
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.44
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)
-1.28
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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