Name: Name:ethyl 6-(chlorosulfonyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
Brand: Angene
SKU: AG01B9BV
Rating: 90 (10 reviews)

ethyl 6-(chlorosulfonyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

CAS No.:

1803591-20-9

Catalog Number:

AG01B9BV

Molecular Formula:

C8H7ClN4O4S

Molecular Weight:

290.6836

Catalog Number:

AG01B9BV

Chemical Name:

ethyl 6-(chlorosulfonyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number:

1803591-20-9

Molecular Formula:

C8H7ClN4O4S

Molecular Weight:

290.6836

MDL Number:

MFCD28397397

IUPAC Name:

ethyl 6-chlorosulfonyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

InChI:

InChI=1S/C8H7ClN4O4S/c1-2-17-7(14)6-11-8-10-3-5(18(9,15)16)4-13(8)12-6/h3-4H,2H2,1H3

InChI Key:

FAADPSSFFKLRJR-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1nc2n(n1)cc(cn2)S(=O)(=O)Cl

Complexity:

425

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

289.988g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.678g/mol

Monoisotopic Mass:

289.988g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

112A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7