Name: Name:5-methyl-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Brand: Angene
SKU: AG019W9F
Rating: 90 (10 reviews)

5-methyl-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid

CAS No.:

210159-14-1

Catalog Number:

AG019W9F

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

Catalog Number:

AG019W9F

Chemical Name:

5-methyl-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylic acid

CAS Number:

210159-14-1

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

MDL Number:

MFCD02168479

IUPAC Name:

5-methyl-1-(3-methylphenyl)triazole-4-carboxylic acid

InChI:

InChI=1S/C11H11N3O2/c1-7-4-3-5-9(6-7)14-8(2)10(11(15)16)12-13-14/h3-6H,1-2H3,(H,15,16)

InChI Key:

CFWWWVDWLUAXPU-UHFFFAOYSA-N

SMILES:

Cc1cccc(c1)n1nnc(c1C)C(=O)O

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.228g/mol

Monoisotopic Mass:

217.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: