CAS RN: 7684-29-9
5-BenzylMorpholin-3-one
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.20251112 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS7684-29-9
- Purity/Analytical Methods: >99.0%
7684-29-9 / 5-benzylmorpholin-3-one
Basic Information
CAS
7684-29-9
Multi CAS
No
Molecular Formula
C11H13NO2
Molecular Weight
191.230000
Exact Mass
191.094629
SMILES
C1C(NC(=O)CO1)CC2=CC=CC=C2
InChI
InChI=1S/C11H13NO2/c13-11-8-14-7-10(12-11)6-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,12,13)
InChIKey
PXPFDUZBGQDAEP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
52.9
TPSA
38.33
LogP / Solubility
WLOGP
0.74
MLOGP
0.65
XLogP3
1.2
Consensus LogP
0.86
Log S (ESOL)
-1.68
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.76
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)
-3.36
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
![CAS 7685-88-3 1-Phenyl-3-[(phenylmethyl)amino]-2,5-pyrrolidinedione molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
1-Phenyl-3-[(phenylmethyl)amino]-2,5-pyrrolidinedione
- CAS RN: 7685-88-3
- Product Code: starshine_CAS7685-88-3
- Purity/Analytical method: >99.0%
-
-
-
2-VINYLCYCLOPROPANE-1,1-DICARBOXYLIC ACID DIETHYL ESTER
- CAS RN: 7686-78-4
- Product Code: SSC-186274
-
N-ALLYL-N N-BIS(TRIMETHYLSILYL)AMINE
- CAS RN: 7688-51-9
- Product Code: starshine_CAS7688-51-9
- Purity/Analytical method: >99.0%
-
1-bromobicyclo[2.2.2]octane
- CAS RN: 7697-09-8
- Product Code: starshine_CAS7697-09-8
- Purity/Analytical method: >99.0%
![CAS 7685-88-3 1-Phenyl-3-[(phenylmethyl)amino]-2,5-pyrrolidinedione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/7685-88-3.gif)
![CAS 7697-09-8 1-bromobicyclo[2.2.2]octane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/7697-09-8.gif)