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CAS 120570-05-0 (S)-quinuclidin-3-aMine molecular structure lightbox
CAS RN: 120570-05-0

(S)-quinuclidin-3-aMine

Product Availability

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4 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260530 100mg Out of stock Inquiry
Batchno.20260611 100mg / 250mg Out of stock 8-10 business days Inquiry
Batchno.20260115 1g In stock Shanghai Inquiry
Batchno.20250220 250mg Out of stock Inquiry
  • Product code: SSC-021587
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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
  • 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 120570-05-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

120570-05-0 / (3S)-1-azabicyclo[2.2.2]octan-3-amine

3-Aminoquinuclidine | RefChem:93007 | quinuclidin-3-amine

Standard CAS: 120570-05-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
120570-05-0
Multi CAS
Yes
Molecular Formula
C7H14N2
Molecular Weight
126.200000
Exact Mass
126.115698
SMILES
C1CN2CCC1[C@@H](C2)N
InChI
InChI=1S/C7H14N2/c8-7-5-9-3-1-6(7)2-4-9/h6-7H,1-5,8H2/t7-/m1/s1
InChIKey
REUAXQZIRFXQML-SSDOTTSWSA-N
Synonyms
3-Aminoquinuclidine RefChem:93007 quinuclidin-3-amine 1-azabicyclo[2.2.2]octan-3-amine 1-aza-bicyclo[2.2.2]oct-3-ylamine

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
37.14
TPSA
29.26

LogP / Solubility

WLOGP
0.04
MLOGP
0.03
XLogP3
-0.1
Consensus LogP
-0.01
Log S (ESOL)
-0.65
Class (ESOL)
Very soluble
Log S (Ali)
-0.62
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.51
Class (SILICOS-IT)
Very 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)
-3.46

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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