Name: Name:3-(methylsulfanyl)-4,5-dihydro-1H-1,2,4-triazol-5-one
Brand: Angene
SKU: AG01B1IF
Rating: 90 (10 reviews)

3-(methylsulfanyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS No.:

53065-40-0

Catalog Number:

AG01B1IF

Molecular Formula:

C3H5N3OS

Molecular Weight:

131.1563

Catalog Number:

AG01B1IF

Chemical Name:

3-(methylsulfanyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS Number:

53065-40-0

Molecular Formula:

C3H5N3OS

Molecular Weight:

131.1563

MDL Number:

MFCD24572809

IUPAC Name:

3-methylsulfanyl-1,4-dihydro-1,2,4-triazol-5-one

InChI:

InChI=1S/C3H5N3OS/c1-8-3-4-2(7)5-6-3/h1H3,(H2,4,5,6,7)

InChI Key:

LCOUXYHXWICRMU-UHFFFAOYSA-N

SMILES:

CSc1n[nH]c(=O)[nH]1

Complexity:

144

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

131.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

131.153g/mol

Monoisotopic Mass:

131.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1