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CAS 29552-58-7 Isopropylamine Hydrobromide molecular structure lightbox
CAS RN: 29552-58-7

Isopropylamine Hydrobromide

  • Product code: SSC-132515
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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: 10g
  • 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 29552-58-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Beijing Inquiry

29552-58-7 / propan-2-amine;hydrobromide

Standard CAS: 29552-58-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
29552-58-7
Multi CAS
No
Molecular Formula
BC3H10Rn
Molecular Weight
140.020000
Exact Mass
138.999660
InChI
InChI=1S/C3H9N.BrH/c1-3(2)4;/h3H,4H2,1-2H3;1H
InChIKey
WGWKNMLSVLOQJB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
29.65
TPSA
26.02

LogP / Solubility

WLOGP
0.93
MLOGP
0.81
XLogP3
0.93
Consensus LogP
0.89
Log S (ESOL)
-1.29
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
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)
-2.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1

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