Name: Name:2-(4-bromophenyl)-2H-1,2,3-triazole-4-carboxylic acid
Brand: Angene
SKU: AG01B2OK
Rating: 90 (10 reviews)

2-(4-bromophenyl)-2H-1,2,3-triazole-4-carboxylic acid

CAS No.:

90224-84-3

Catalog Number:

AG01B2OK

Molecular Formula:

C9H6BrN3O2

Molecular Weight:

268.0668

Catalog Number:

AG01B2OK

Chemical Name:

2-(4-bromophenyl)-2H-1,2,3-triazole-4-carboxylic acid

CAS Number:

90224-84-3

Molecular Formula:

C9H6BrN3O2

Molecular Weight:

268.0668

MDL Number:

MFCD03942289

IUPAC Name:

2-(4-bromophenyl)triazole-4-carboxylic acid

InChI:

InChI=1S/C9H6BrN3O2/c10-6-1-3-7(4-2-6)13-11-5-8(12-13)9(14)15/h1-5H,(H,14,15)

InChI Key:

RDTUEBIGFMOKQK-UHFFFAOYSA-N

SMILES:

Brc1ccc(cc1)n1ncc(n1)C(=O)O

Complexity:

244

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.964g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

268.07g/mol

Monoisotopic Mass:

266.964g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5