CAS RN: 639-97-4
3-C-(HYDROXYMETHYL)-D-GLYCERO-TETROSE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250313 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS639-97-4
- Purity/Analytical Methods: >99.0%
639-97-4 / 2,3,4-trihydroxy-3-(hydroxymethyl)butanal
Basic Information
CAS
639-97-4
Multi CAS
Yes
Molecular Formula
C5H10O5
Molecular Weight
150.130000
Exact Mass
150.052823
InChI
InChI=1S/C5H10O5/c6-1-4(9)5(10,2-7)3-8/h1,4,7-10H,2-3H2
InChIKey
AVGPOAXYRRIZMM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.8
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
4
Molar refractivity
31.19
TPSA
97.99
LogP / Solubility
WLOGP
-2.74
MLOGP
-2.42
XLogP3
-3.1
Consensus LogP
-2.75
Log S (ESOL)
1.22
Class (ESOL)
Highly soluble
Log S (Ali)
1.19
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.16
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.58
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
2
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![CAS 641-38-3 3,7,9-TRIHYDROXY-1-METHYL-6H-DIBENZO[B,D]PYRAN-6-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/641-38-3.gif)
