Name: Name:3-Methyl-[1,2,4]thiadiazole-5-carboxylic acid ethyl ester
Brand: Angene
SKU: AG00G87B
Rating: 90 (10 reviews)

3-Methyl-[1,2,4]thiadiazole-5-carboxylic acid ethyl ester

CAS No.:

76162-56-6

Catalog Number:

AG00G87B

Molecular Formula:

C6H8N2O2S

Molecular Weight:

172.2049

Catalog Number:

AG00G87B

Chemical Name:

3-Methyl-[1,2,4]thiadiazole-5-carboxylic acid ethyl ester

CAS Number:

76162-56-6

Molecular Formula:

C6H8N2O2S

Molecular Weight:

172.2049

MDL Number:

MFCD22201205

IUPAC Name:

ethyl 3-methyl-1,2,4-thiadiazole-5-carboxylate

InChI:

InChI=1S/C6H8N2O2S/c1-3-10-6(9)5-7-4(2)8-11-5/h3H2,1-2H3

InChI Key:

ZYVYMUYJEAVYOC-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1snc(n1)C

Complexity:

154

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.202g/mol

Monoisotopic Mass:

172.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7