Name: Name:5-[4-bromo-2-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01ALSA
Rating: 90 (10 reviews)

5-[4-bromo-2-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole

CAS No.:

1249252-67-2

Catalog Number:

AG01ALSA

Molecular Formula:

C8H4BrF3N4

Molecular Weight:

293.0434

Catalog Number:

AG01ALSA

Chemical Name:

5-[4-bromo-2-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazole

CAS Number:

1249252-67-2

Molecular Formula:

C8H4BrF3N4

Molecular Weight:

293.0434

MDL Number:

MFCD16839136

IUPAC Name:

5-[4-bromo-2-(trifluoromethyl)phenyl]-2H-tetrazole

InChI:

InChI=1S/C8H4BrF3N4/c9-4-1-2-5(7-13-15-16-14-7)6(3-4)8(10,11)12/h1-3H,(H,13,14,15,16)

InChI Key:

FPWUGLSGVHGFDB-UHFFFAOYSA-N

SMILES:

Brc1ccc(c(c1)C(F)(F)F)c1nnn[nH]1

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.957g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

293.047g/mol

Monoisotopic Mass:

291.957g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7