CAS RN: 41637-38-1

Bisphenol A Ethoxylate Dimethacrylate (m+n= approx. 4) (stabilized with HQ)

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Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250401 500g / 2.5kg / 10kg Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: ICTB6286
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41637-38-1 / 2-[4-[2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]phenyl]propan-2-yl]phenoxy]ethyl 2-methylprop-2-enoate

Standard CAS: 41637-38-1 Multi CAS: Yes

Basic Information

CAS
41637-38-1
Multi CAS
Yes
Molecular Formula
C27H32O6
Molecular Weight
452.500000
Exact Mass
452.219889
InChI
InChI=1S/C15H16O2.C3H4O2.C2H6O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;1-2-3(4)5;3-1-2-4/h3-10,16-17H,1-2H3;2H,1H2,(H,4,5);3-4H,1-2H2
InChIKey
HGARWRTUWINPJC-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid Green liquid with a sharp odor; Yellowish oily liquid with an ester-like odor
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
33
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
12
H-bond acceptors
6
Molar refractivity
127.55
TPSA
71.06

LogP / Solubility

WLOGP
5.01
MLOGP
4.44
XLogP3
6.4
Consensus LogP
5.28
Log S (ESOL)
-5.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.89
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.2
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.92

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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