CAS RN: 191849-71-5
3-ETHOXYBENZENE-1,2-DIAMINE
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.20260103 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS191849-71-5
- Purity/Analytical Methods: >99.0%
191849-71-5 / 3-ethoxybenzene-1,2-diamine
Basic Information
CAS
191849-71-5
Multi CAS
No
Molecular Formula
C8H12N2O
Molecular Weight
152.190000
Exact Mass
152.094963
SMILES
CCOC1=CC=CC(=C1N)N
InChI
InChI=1S/C8H12N2O/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2,9-10H2,1H3
InChIKey
GBMGXXPFNLJLMP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
46.44
TPSA
61.27
LogP / Solubility
WLOGP
1.25
MLOGP
1.09
XLogP3
0.9
Consensus LogP
1.08
Log S (ESOL)
-1.84
Class (ESOL)
Soluble
Log S (Ali)
-1.71
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)
-2.76
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
-
![CAS 191868-14-1 N-[(1R)-1-[[[[4-[[(Aminocarbonyl)amino]methyl]phenyl]methyl]amino]carbonyl]-4-[(aminoiminomethyl)amino]butyl]-α-phenyl-benzeneacetamideditrifluoroacetate molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
N-[(1R)-1-[[[[4-[[(Aminocarbonyl)amino]methyl]phenyl]methyl]amino]carbonyl]-4-[(aminoiminomethyl)amino]butyl]-α-phenyl-benzeneacetamideditrifluoroacetate
- CAS RN: 191868-14-1
- Product Code: starshine_CAS191868-14-1
- Purity/Analytical method: >99.0%
-
(4-cyanophenyl)methanesulfonamide
- CAS RN: 191868-54-9
- Product Code: starshine_CAS191868-54-9
- Purity/Analytical method: >99.0%
-
TERT-BUTYL 4-((METHOXYCARBONYL)METHYL)BENZYLCARBAMATE
- CAS RN: 191871-32-6
- Product Code: SSC-089850
-
tert-Butyl 4-(aminomethyl)phenyl(methyl)carbamate
- CAS RN: 191871-91-7
- Product Code: SSC-089851
-
-
(Z)-7-[(1S,2R,3R,5S)-3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]hept-5-enoic acid
- CAS RN: 191919-02-5
- Product Code: starshine_CAS191919-02-5
- Purity/Analytical method: >99.0%
![CAS 191868-14-1 N-[(1R)-1-[[[[4-[[(Aminocarbonyl)amino]methyl]phenyl]methyl]amino]carbonyl]-4-[(aminoiminomethyl)amino]butyl]-α-phenyl-benzeneacetamideditrifluoroacetate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/191868-14-1.gif)
![CAS 191919-02-5 (Z)-7-[(1S,2R,3R,5S)-3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]hept-5-enoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/191919-02-5.gif)