AG01DUBR

Name: 3-methanesulfinyl-4H-1,2,4-triazole
Brand: Angene Chemical
SKU: AG01DUBR

1258639-46-1 | 3-methanesulfinyl-4H-1,2,4-triazole

AG01DUBR

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CAS Number	1258639-46-1
Catalog Number	AG01DUBR
Chemical Name	3-methanesulfinyl-4H-1,2,4-triazole
IUPAC Name	5-methylsulfinyl-1H-1,2,4-triazole
InChI	InChI=1S/C3H5N3OS/c1-8(7)3-4-2-5-6-3/h2H,1H3,(H,4,5,6)
InChI Key	UOMCXNNOJBMXTJ-UHFFFAOYSA-N
MDL Number	MFCD18783028
Molecular Formula	C3H5N3OS
Molecular Weight	131.1563
SMILES	CS(C1NC=NN=1)=O
Synonyms	3-methanesulfinyl-4H-1,2,4-triazole, 3-(methylsulfinyl)-1H-1,2,4-triazole, 1258639-46-1, AC1Q4GS6, SCHEMBL11959860, UOMCXNNOJBMXTJ-UHFFFAOYSA-N, BBL013230, MFCD18783028, STL164017, AKOS005720993, 3-Methanesulfinyl-1H-1,2,4-triazole, MCULE-3351909590, NE19430, EN300-70072, Z1258992473, 5-methylsulfinyl-1H-1,2,4-triazole,

Complexity	107
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	131.015g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	131.153g/mol
Monoisotopic Mass	131.015g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	77.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited