Name: Name:5-bromo-1H-1,2,3-benzotriazole-7-carboxylic acid
Brand: Angene
SKU: AG01AC1R
Rating: 90 (10 reviews)

5-bromo-1H-1,2,3-benzotriazole-7-carboxylic acid

CAS No.:

1354777-44-8

Catalog Number:

AG01AC1R

Molecular Formula:

C7H4BrN3O2

Molecular Weight:

242.0296

Catalog Number:

AG01AC1R

Chemical Name:

5-bromo-1H-1,2,3-benzotriazole-7-carboxylic acid

CAS Number:

1354777-44-8

Molecular Formula:

C7H4BrN3O2

Molecular Weight:

242.0296

MDL Number:

MFCD20501470

IUPAC Name:

6-bromo-2H-benzotriazole-4-carboxylic acid

InChI:

InChI=1S/C7H4BrN3O2/c8-3-1-4(7(12)13)6-5(2-3)9-11-10-6/h1-2H,(H,12,13)(H,9,10,11)

InChI Key:

SRLIKUKKKGJCOR-UHFFFAOYSA-N

SMILES:

Brc1cc2nn[nH]c2c(c1)C(=O)O

Complexity:

226

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.949g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.032g/mol

Monoisotopic Mass:

240.949g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2