Name: Name:1,2,3-Thiadiazole-5-carboxylicacid,4-(1-methylethyl)-,ethylester(9CI)
Brand: Angene
SKU: AG00AE33
Rating: 90 (10 reviews)

1,2,3-Thiadiazole-5-carboxylicacid,4-(1-methylethyl)-,ethylester(9CI)

CAS No.:

183302-79-6

Catalog Number:

AG00AE33

Molecular Formula:

C8H12N2O2S

Molecular Weight:

200.2581

Catalog Number:

AG00AE33

Chemical Name:

1,2,3-Thiadiazole-5-carboxylicacid,4-(1-methylethyl)-,ethylester(9CI)

CAS Number:

183302-79-6

Molecular Formula:

C8H12N2O2S

Molecular Weight:

200.2581

MDL Number:

MFCD01935978

IUPAC Name:

ethyl 4-propan-2-ylthiadiazole-5-carboxylate

InChI:

InChI=1S/C8H12N2O2S/c1-4-12-8(11)7-6(5(2)3)9-10-13-7/h5H,4H2,1-3H3

InChI Key:

WKKQOGJHTXSUIQ-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1snnc1C(C)C

Complexity:

187

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

200.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

200.256g/mol

Monoisotopic Mass:

200.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2