[email protected]
CAS 1257854-97-9 (R)-2-Morpholineacetic acid molecular structure lightbox
CAS RN: 1257854-97-9

(R)-2-Morpholineacetic acid

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250416 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS1257854-97-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1257854-97-9 / 2-[(2R)-morpholin-2-yl]acetic acid

Standard CAS: 1257854-97-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1257854-97-9
Multi CAS
No
Molecular Formula
C6H11NO3
Molecular Weight
145.160000
Exact Mass
145.073893
SMILES
C1CO[C@@H](CN1)CC(=O)O
InChI
InChI=1S/C6H11NO3/c8-6(9)3-5-4-7-1-2-10-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1
InChIKey
TWCXRVFSIAWFMA-RXMQYKEDSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.83
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
34.86
TPSA
58.56

LogP / Solubility

WLOGP
-0.55
MLOGP
-0.49
XLogP3
-3.3
Consensus LogP
-1.45
Log S (ESOL)
-0.26
Class (ESOL)
Very soluble
Log S (Ali)
-0.35
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.39
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

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

Get In Touch

Contact Us