CAS
911836-38-9 Purity
96%
911836-38-9 Purity
96%
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Iflab-bb f0820-0242
CAS
91184-07-5
Catalog Number
ACM91184075
Category
Other Products
Molecular Weight
182.2
Molecular Formula
C6H6N4OS
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Specification
Synonyms
IFLAB-BB F0820-0242;TOSLAB 864533;3-MERCAPTO-5-METHYL-8H-[1,2,4]TRIAZOLO[4,3-A]PYRIMIDIN-7-ONE
What is the molecular formula of Iflab-bb f0820-0242?
The molecular formula of Iflab-bb f0820-0242 is C6H6N4OS.
When was Iflab-bb f0820-0242 created and last modified?
Iflab-bb f0820-0242 was created on 2019-01-15 and last modified on 2023-12-30.
What is the IUPAC name of Iflab-bb f0820-0242?
The IUPAC name of Iflab-bb f0820-0242 is 5-methyl-3-sulfanylidene-2,8-dihydro-[1,2,4]triazolo[4,3-a]pyrimidin-7-one.
What is the InChI of Iflab-bb f0820-0242?
The InChI of Iflab-bb f0820-0242 is InChI=1S/C6H6N4OS/c1-3-2-4(11)7-5-8-9-6(12)10(3)5/h2H,1H3,(H,9,12)(H,7,8,11).
What is the InChIKey of Iflab-bb f0820-0242?
The InChIKey of Iflab-bb f0820-0242 is HCODANNGUOSOCH-UHFFFAOYSA-N.
What is the Canonical SMILES of Iflab-bb f0820-0242?
The Canonical SMILES of Iflab-bb f0820-0242 is CC1=CC(=O)NC2=NNC(=S)N12.
What is the molecular weight of Iflab-bb f0820-0242?
The molecular weight of Iflab-bb f0820-0242 is 182.21 g/mol.
How many hydrogen bond donor counts does Iflab-bb f0820-0242 have?
Iflab-bb f0820-0242 has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of Iflab-bb f0820-0242?
The XLogP3-AA value of Iflab-bb f0820-0242 is -0.2.
Is Iflab-bb f0820-0242 a canonicalized compound according to PubChem?
Yes, Iflab-bb f0820-0242 is a canonicalized compound according to PubChem.
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