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CAS 942308-06-7 3-(METHOXYMETHYL)AZETIDINE HYDROCHLORIDE molecular structure lightbox
CAS RN: 942308-06-7

3-(METHOXYMETHYL)AZETIDINE HYDROCHLORIDE

  • Product code: SSC-208864
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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, 5g, 10g, 25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 942308-06-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry
10g ≥95% 0 Out of Stock Hong Kong Inquiry
25g ≥95% 0 Out of Stock Hong Kong Inquiry

942308-06-7 / 3-(methoxymethyl)azetidine;hydrochloride

Standard CAS: 942308-06-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
942308-06-7
Multi CAS
Yes
Molecular Formula
C5H12CLNO
Molecular Weight
137.610000
Exact Mass
137.060742
InChI
InChI=1S/C5H11NO.ClH/c1-7-4-5-2-6-3-5;/h5-6H,2-4H2,1H3;1H
InChIKey
PPXSXGZXOLBWJR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
35.48
TPSA
21.26

LogP / Solubility

WLOGP
0.27
MLOGP
0.23
XLogP3
0.27
Consensus LogP
0.26
Log S (ESOL)
-0.73
Class (ESOL)
Very soluble
Log S (Ali)
-0.89
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.02
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
1.5

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