CAS RN: 870991-70-1
(1R,2R)-1,2-Bis(2-hydroxyphenyl)ethylenediamine
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250213 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20250528 | 10g | In stock | Shanghai | Inquiry |
| Batchno.20260531 | 1g | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20250822 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20251109 | 25g | In stock | Shanghai | Inquiry |
| Batchno.20250810 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-196627
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: 0.1g, 0.25g, 1g, 5g
- Available purity: >95%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
870991-70-1 / 2-[1,2-diamino-2-(2-hydroxyphenyl)ethyl]phenol
Basic Information
CAS
870991-70-1
Multi CAS
Yes
Molecular Formula
C14H16N2O2
Molecular Weight
244.290000
Exact Mass
244.121178
InChI
InChI=1S/C14H16N2O2/c15-13(9-5-1-3-7-11(9)17)14(16)10-6-2-4-8-12(10)18/h1-8,13-14,17-18H,15-16H2
InChIKey
MRNPLGLZBUDMRE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
4
Molar refractivity
70.07
TPSA
92.5
LogP / Solubility
WLOGP
1.8
MLOGP
1.59
XLogP3
1.8
Consensus LogP
1.73
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.86
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.1
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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