![CAS 96478-09-0 2-[2-Hydroxy-5-[2-(methacryloyloxy)ethyl]phenyl]-2H-benzotriazole molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/h1261-jpgcontextbwfzdgvyfhjvb3r8mjk4nzl8aw1hz2uvanblz3xom2ivagmylzg5mza5oduxmtu2nzgvsdeynjeuanbnfdg4zwvjzgu0ywu4zdi5zjllnzkyzta5yjjjyta4mtdlzgzjyje0otjjyta0n2qym2ewzwq4zwu3nmfmzwzkntq.jpeg)
CAS RN: 96478-09-0
2-[2-Hydroxy-5-[2-(methacryloyloxy)ethyl]phenyl]-2H-benzotriazole
Product Availability
Choose a grade to view its available package options.
7 package records4 with current stock2 grade groups
- Product code: SSC-212010
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: 25g
- Available purity: ≥98%
- 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 |
|---|---|---|---|---|
| 25g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
96478-09-0 / 2-[3-(benzotriazol-2-yl)-4-hydroxyphenyl]ethyl 2-methylprop-2-enoate
Basic Information
CAS
96478-09-0
Multi CAS
Yes
Molecular Formula
C18H17N3O3
Molecular Weight
323.300000
Exact Mass
323.126991
InChI
InChI=1S/C18H17N3O3/c1-12(2)18(23)24-10-9-13-7-8-17(22)16(11-13)21-19-14-5-3-4-6-15(14)20-21/h3-8,11,22H,1,9-10H2,2H3
InChIKey
VCYCUECVHJJFIQ-UHFFFAOYSA-N
Physical Properties
Physical Description
Dry Powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
15
Fraction Csp3
0.17
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
1
Molar refractivity
90.01
TPSA
77.24
LogP / Solubility
WLOGP
2.79
MLOGP
2.47
XLogP3
5.1
Consensus LogP
3.45
Log S (ESOL)
-3.73
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.68
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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