[email protected]
CAS 22304-67-2 4,6-Dihydroxy-5-methyl-1,3-diformyl benzene molecular structure lightbox
CAS RN: 22304-67-2

4,6-Dihydroxy-5-methyl-1,3-diformyl benzene

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260101 100mg In stock Inquiry
Batchno.20250217 1g In stock Inquiry
Batchno.20250508 250mg In stock Inquiry
Batchno.20251206 5g In stock Inquiry
  • Product code: SSC-108609
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: 1g
  • Available purity: ＞97%
  • 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 22304-67-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

22304-67-2 / 4,6-dihydroxy-5-methylbenzene-1,3-dicarbaldehyde

Standard CAS: 22304-67-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22304-67-2
Multi CAS
No
Molecular Formula
C9H8O4
Molecular Weight
180.160000
Exact Mass
180.042259
SMILES
CC1=C(C(=CC(=C1O)C=O)C=O)O
InChI
InChI=1S/C9H8O4/c1-5-8(12)6(3-10)2-7(4-11)9(5)13/h2-4,12-13H,1H3
InChIKey
PBDGBKWOAPXYHT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
45.28
TPSA
74.6

LogP / Solubility

WLOGP
1.03
MLOGP
0.91
XLogP3
1.6
Consensus LogP
1.18
Log S (ESOL)
-1.82
Class (ESOL)
Soluble
Log S (Ali)
-1.78
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.93
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.09

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us