Name: Name:Methyl 1-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,3-triazole-4-carboxylate
Brand: Angene
SKU: AG00CCHT
Rating: 90 (10 reviews)

Methyl 1-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,3-triazole-4-carboxylate

CAS No.:

23947-13-9

Catalog Number:

AG00CCHT

Molecular Formula:

C10H11N5O2

Molecular Weight:

233.2266

Catalog Number:

AG00CCHT

Chemical Name:

Methyl 1-(4,6-dimethylpyrimidin-2-yl)-1H-1,2,3-triazole-4-carboxylate

CAS Number:

23947-13-9

Molecular Formula:

C10H11N5O2

Molecular Weight:

233.2266

MDL Number:

MFCD00838109

IUPAC Name:

methyl 1-(4,6-dimethylpyrimidin-2-yl)triazole-4-carboxylate

InChI:

InChI=1S/C10H11N5O2/c1-6-4-7(2)12-10(11-6)15-5-8(13-14-15)9(16)17-3/h4-5H,1-3H3

InChI Key:

YPZMDXXWLAHBPI-UHFFFAOYSA-N

SMILES:

COC(=O)c1nnn(c1)c1nc(C)cc(n1)C

Complexity:

278

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.231g/mol

Monoisotopic Mass:

233.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9