CAS RN: 1315051-74-1
(3S)-4-Methyl-3-Morpholinecarboxylic Acid
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.20251207 | 50mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1315051-74-1
- Purity/Analytical Methods: >99.0%
1315051-74-1 / (3S)-4-methylmorpholine-3-carboxylic acid
Basic Information
CAS
1315051-74-1
Multi CAS
No
Molecular Formula
C6H11NO3
Molecular Weight
145.160000
Exact Mass
145.073893
SMILES
CN1CCOC[C@H]1C(=O)O
InChI
InChI=1S/C6H11NO3/c1-7-2-3-10-4-5(7)6(8)9/h5H,2-4H2,1H3,(H,8,9)/t5-/m0/s1
InChIKey
PJCXUSBLNCTAJP-YFKPBYRVSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.83
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.87
TPSA
49.77
LogP / Solubility
WLOGP
-0.6
MLOGP
-0.53
XLogP3
-2.8
Consensus LogP
-1.31
Log S (ESOL)
-0.3
Class (ESOL)
Very soluble
Log S (Ali)
-0.32
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.23
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
(S)-3-aminotetrahydrofuran-3-carboxylic acid
- CAS RN: 1315052-80-2
- Product Code: SSC-038640
-
-
(R)-3-AMINOTETRAHYDROFURAN-3-CARBOXYLIC ACID
- CAS RN: 1315053-78-1
- Product Code: SSC-038643
-
(R)-3-Hydroxy-N,N-diMethylpyrrolidine-1-carboxaMide
- CAS RN: 1315054-87-5
- Product Code: SSC-038644
-
-
2-[2-(3-Chlorophenyl)ethyl]-4,4,5,5-tetraMethyl-1,3,2-dioxaborolane
- CAS RN: 1315277-53-2
- Product Code: SSC-038661
![CAS 1315277-53-2 2-[2-(3-Chlorophenyl)ethyl]-4,4,5,5-tetraMethyl-1,3,2-dioxaborolane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB12704886.gif)