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CAS 73630-93-0 1-BROMO-N N,2-TRIMETHYLPROPENYLAMINE molecular structure lightbox
CAS RN: 73630-93-0

1-BROMO-N N,2-TRIMETHYLPROPENYLAMINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250415 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS73630-93-0
  • Purity/Analytical Methods: >99.0%
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73630-93-0 / 1-bromo-N,N,2-trimethylprop-1-en-1-amine

Standard CAS: 73630-93-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
73630-93-0
Multi CAS
Yes
Molecular Formula
BC6H12Rn
Molecular Weight
178.070000
Exact Mass
177.015310
InChI
InChI=1S/C6H12BrN/c1-5(2)6(7)8(3)4/h1-4H3
InChIKey
RABYYIXYBKFZPT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
40.99
TPSA
3.24

LogP / Solubility

WLOGP
2.19
MLOGP
1.93
XLogP3
2.7
Consensus LogP
2.27
Log S (ESOL)
-2.26
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.6
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
Class (SILICOS-IT)
Moderately 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)
-2.25

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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