[email protected]
CAS 1187929-79-8 (S)-3-AMINOMETHYL-MORPHOLINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER molecular structure lightbox
CAS RN: 1187929-79-8

(S)-3-AMINOMETHYL-MORPHOLINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251101 100mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260520 100mg / 250mg / 1g Out of stock 15 business days Inquiry
Batchno.20250602 1g In stock Shanghai Inquiry
Batchno.20260517 250mg In stock Shanghai Inquiry
  • Product code: SSC-018821
GET A QUOTE
Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1187929-79-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

1187929-79-8 / tert-butyl (3S)-3-(aminomethyl)morpholine-4-carboxylate

(R)-tert-Butyl 3-(aminomethyl)morpholine-4-carboxylate | (R)-4-Boc-3-aminomethylmorpholine | tert-Butyl (3R)-3-(aminomethyl)morpholine-4-carboxylate

Standard CAS: 1187929-79-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1187929-79-8
Multi CAS
Yes
Molecular Formula
C10H20N2O3
Molecular Weight
216.280000
Exact Mass
216.147393
SMILES
CC(C)(C)OC(=O)N1CCOC[C@@H]1CN
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(13)12-4-5-14-7-8(12)6-11/h8H,4-7,11H2,1-3H3/t8-/m0/s1
InChIKey
IRSSIQNSBCQILH-QMMMGPOBSA-N
Synonyms
(R)-tert-Butyl 3-(aminomethyl)morpholine-4-carboxylate (R)-4-Boc-3-aminomethylmorpholine tert-Butyl (3R)-3-(aminomethyl)morpholine-4-carboxylate (R)-3-AMINOMETHYL-MORPHOLINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER MFCD06739119

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.9
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
56.6
TPSA
64.79

LogP / Solubility

WLOGP
0.58
MLOGP
0.51
XLogP3
-0.1
Consensus LogP
0.33
Log S (ESOL)
-1.48
Class (ESOL)
Soluble
Log S (Ali)
-1.75
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.67
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)
-3.63

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Customers Also Viewed

Get In Touch

Contact Us