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Azepan-1-yl-[7-chloro-4-thiophen-2-yl-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]methanone is a complex organic compound with a molecular formula of C16H15ClF3N4OS. It features a 1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl core structure, which is a bicyclic system with a triazole ring fused to a nonahydro-1,5,9-triazabicyclo[4.3.0]nonane. The compound is further characterized by a 7-chloro-4-thiophen-2-yl group and a trifluoromethyl substituent. The azepan-1-yl group is attached to the carbonyl carbon, indicating the presence of a ketone functional group. This molecule is likely to be of interest in medicinal chemistry due to its potential as a precursor or intermediate in the synthesis of pharmaceuticals, given its diverse functional groups and structural complexity.

5678-77-3

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5678-77-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5678-77-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,6,7 and 8 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 5678-77:
(6*5)+(5*6)+(4*7)+(3*8)+(2*7)+(1*7)=133
133 % 10 = 3
So 5678-77-3 is a valid CAS Registry Number.
InChI:InChI=1/C18H16ClF3N4OS/c19-14-15(17(27)25-7-3-1-2-4-8-25)24-26-13(18(20,21)22)10-11(23-16(14)26)12-6-5-9-28-12/h5-6,9-10H,1-4,7-8H2

5678-77-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name azepan-1-yl-[3-chloro-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone

1.2 Other means of identification

Product number -
Other names 3,3'-Hydrazono-di-propionitril

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
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