[email protected]
CAS 6390-69-8 3,3′,5,5′-Tetra-tert-butyl-2,2′-dihydroxybiphenyl molecular structure lightbox
CAS RN: 6390-69-8

3,3′,5,5′-Tetra-tert-butyl-2,2′-dihydroxybiphenyl

  • Product code: SSC-173686
GET A QUOTE
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: 10g, 25g
  • Available purity: ≥98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 6390-69-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 0 Out of Stock Shanghai Inquiry
25g ≥98% 0 Out of Stock Shanghai Inquiry

6390-69-8 / 2,4-ditert-butyl-6-(3,5-ditert-butyl-2-hydroxyphenyl)phenol

Standard CAS: 6390-69-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6390-69-8
Multi CAS
Yes
Molecular Formula
C28H42O2
Molecular Weight
410.600000
Exact Mass
410.318481
InChI
InChI=1S/C28H42O2/c1-25(2,3)17-13-19(23(29)21(15-17)27(7,8)9)20-14-18(26(4,5)6)16-22(24(20)30)28(10,11)12/h13-16,29-30H,1-12H3
InChIKey
GDGDLBOVIAWEAD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
130.01
TPSA
40.46

LogP / Solubility

WLOGP
7.95
MLOGP
7.03
XLogP3
9.5
Consensus LogP
8.16
Log S (ESOL)
-7.63
Class (ESOL)
Insoluble
Log S (Ali)
-8.67
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.05
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
0.42

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us