CAS RN: 1011714-83-2

4,4`-Bis[6-(acryloyloxy)hexyloxy]azobenzene

  • Product code: SSC-002026
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 5g, 10g, 25g, 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1011714-83-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 5 In Stock Beijing Inquiry
1g ≥95% 5 In Stock Shanghai Inquiry
5g ≥95% 5 In Stock Beijing Inquiry
10g ≥95% 5 In Stock Beijing Inquiry
25g ≥95% 5 In Stock Beijing Inquiry
0.1g ≥95% 2 In Stock Shanghai Inquiry

1011714-83-2 / 6-[4-[[4-(6-prop-2-enoyloxyhexoxy)phenyl]diazenyl]phenoxy]hexyl prop-2-enoate

4,4'-Bis[6-(acryloyloxy)hexyloxy]azobenzene | MFCD29059443 | 4,4`-Bis[6-(acryloyloxy)hexyloxy]azobenzene

Standard CAS: 1011714-83-2 Multi CAS: No

Basic Information

CAS
1011714-83-2
Multi CAS
No
Molecular Formula
C30H38N2O6
Molecular Weight
522.600000
Exact Mass
522.272987
SMILES
C=CC(=O)OCCCCCCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCCOC(=O)C=C
InChI
InChI=1S/C30H38N2O6/c1-3-29(33)37-23-11-7-5-9-21-35-27-17-13-25(14-18-27)31-32-26-15-19-28(20-16-26)36-22-10-6-8-12-24-38-30(34)4-2/h3-4,13-20H,1-2,5-12,21-24H2
InChIKey
ZKVZWOFJEDEZFP-UHFFFAOYSA-N
Synonyms
4,4'-Bis[6-(acryloyloxy)hexyloxy]azobenzene MFCD29059443 4,4`-Bis[6-(acryloyloxy)hexyloxy]azobenzene ((Diazene-1,2-diylbis(4,1-phenylene))bis(oxy))bis(hexane-6,1-diyl) diacrylate 4,4 inverted exclamation mark -Bis[6-(acryloyloxy)hexyloxy]azobenzene

Computed Properties

Structural Parameters

Heavy atom count
38
Aromatic heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
20
H-bond acceptors
8
Molar refractivity
147.3
TPSA
95.78

LogP / Solubility

WLOGP
7.44
MLOGP
6.58
XLogP3
7.5
Consensus LogP
7.17
Log S (ESOL)
-6.68
Class (ESOL)
Insoluble
Log S (Ali)
-9.22
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.63
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.63

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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