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CAS 6943-51-7 2-Propen-1-amine,2-bromo- (9CI) molecular structure lightbox
CAS RN: 6943-51-7

2-Propen-1-amine,2-bromo- (9CI)

  • Product code: SSC-179119
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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: ≥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 6943-51-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

6943-51-7 / 2-bromoprop-2-en-1-amine

Standard CAS: 6943-51-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
6943-51-7
Multi CAS
No
Molecular Formula
BC3H6Rn
Molecular Weight
135.990000
Exact Mass
134.968360
InChI
InChI=1S/C3H6BrN/c1-3(4)2-5/h1-2,5H2
InChIKey
XFSISDMYBCYBKG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
27.12
TPSA
26.02

LogP / Solubility

WLOGP
0.85
MLOGP
0.74
XLogP3
0.4
Consensus LogP
0.66
Log S (ESOL)
-1.15
Class (ESOL)
Soluble
Log S (Ali)
-1.29
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.37
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)
-2.94

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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