[email protected]
CAS 168473-14-1 1,14-TETRADECANEDIOL DIMETHACRYLATE, TEC H. molecular structure lightbox
CAS RN: 168473-14-1

1,14-TETRADECANEDIOL DIMETHACRYLATE, TEC H.

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260529 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS168473-14-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

168473-14-1 / 14-(2-methylprop-2-enoyloxy)tetradecyl 2-methylprop-2-enoate

Standard CAS: 168473-14-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
168473-14-1
Multi CAS
No
Molecular Formula
C22H38O4
Molecular Weight
366.500000
Exact Mass
366.277010
SMILES
CC(=C)C(=O)OCCCCCCCCCCCCCCOC(=O)C(=C)C
InChI
InChI=1S/C22H38O4/c1-19(2)21(23)25-17-15-13-11-9-7-5-6-8-10-12-14-16-18-26-22(24)20(3)4/h1,3,5-18H2,2,4H3
InChIKey
PYLRGSOFJMYQNO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
0.73
Rotatable bonds
17
H-bond acceptors
4
Molar refractivity
106.95
TPSA
52.6

LogP / Solubility

WLOGP
5.91
MLOGP
5.22
XLogP3
7.7
Consensus LogP
6.28
Log S (ESOL)
-4.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.83
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.98
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.76

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

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501

Customers Also Viewed

Get In Touch

Contact Us