Name: Name:1-(2-bromophenyl)-1H-1,2,3-triazole-5-carboxylic acid
Brand: Angene
SKU: AG01BIE1
Rating: 90 (10 reviews)

1-(2-bromophenyl)-1H-1,2,3-triazole-5-carboxylic acid

CAS No.:

1049130-05-3

Catalog Number:

AG01BIE1

Molecular Formula:

C9H6BrN3O2

Molecular Weight:

268.0668

Catalog Number:

AG01BIE1

Chemical Name:

1-(2-bromophenyl)-1H-1,2,3-triazole-5-carboxylic acid

CAS Number:

1049130-05-3

Molecular Formula:

C9H6BrN3O2

Molecular Weight:

268.0668

MDL Number:

MFCD11559208

IUPAC Name:

3-(2-bromophenyl)triazole-4-carboxylic acid

InChI:

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

InChI Key:

UQJPNJDJIOHRCD-UHFFFAOYSA-N

SMILES:

Brc1ccccc1n1nncc1C(=O)O

Complexity:

252

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:

1.9