Name: Name:1-(2,6-dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid
Brand: Angene
SKU: AG01AAHB
Rating: 90 (10 reviews)

1-(2,6-dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid

CAS No.:

1154101-06-0

Catalog Number:

AG01AAHB

Molecular Formula:

C10H7Cl2N3O2

Molecular Weight:

272.0875

Catalog Number:

AG01AAHB

Chemical Name:

1-(2,6-dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid

CAS Number:

1154101-06-0

Molecular Formula:

C10H7Cl2N3O2

Molecular Weight:

272.0875

MDL Number:

MFCD12106486

IUPAC Name:

1-(2,6-dichlorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid

InChI:

InChI=1S/C10H7Cl2N3O2/c1-5-13-9(10(16)17)14-15(5)8-6(11)3-2-4-7(8)12/h2-4H,1H3,(H,16,17)

InChI Key:

MADPRXZRBSFAKV-UHFFFAOYSA-N

SMILES:

Clc1cccc(c1n1nc(nc1C)C(=O)O)Cl

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.992g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.085g/mol

Monoisotopic Mass:

270.992g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2