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CAS 4415-83-2 Cyclobutylmethylamine hydrochloride molecular structure lightbox
CAS RN: 4415-83-2

Cyclobutylmethylamine hydrochloride

  • Product code: SSC-152169
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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: 5g
  • Available purity: ＞97%
  • 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 4415-83-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

4415-83-2 / cyclobutylmethanamine

Standard CAS: 4415-83-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4415-83-2
Multi CAS
No
Molecular Formula
C5H11N
Molecular Weight
85.150000
Exact Mass
85.089149
InChI
InChI=1S/C5H11N/c6-4-5-2-1-3-5/h5H,1-4,6H2
InChIKey
LQNHRNOPWKZUSN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
26.4
TPSA
26.02

LogP / Solubility

WLOGP
0.75
MLOGP
0.64
XLogP3
0.6
Consensus LogP
0.66
Log S (ESOL)
-0.77
Class (ESOL)
Very soluble
Log S (Ali)
-0.8
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.95
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)
-2.71

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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