Name: Name:5-[(2,4-difluorophenyl)methyl]-1H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01DWUZ
Rating: 90 (10 reviews)

5-[(2,4-difluorophenyl)methyl]-1H-1,2,3,4-tetrazole

CAS No.:

925698-99-3

Catalog Number:

AG01DWUZ

Molecular Formula:

C8H6F2N4

Molecular Weight:

196.1568

Catalog Number:

AG01DWUZ

Chemical Name:

5-[(2,4-difluorophenyl)methyl]-1H-1,2,3,4-tetrazole

CAS Number:

925698-99-3

Molecular Formula:

C8H6F2N4

Molecular Weight:

196.1568

MDL Number:

MFCD16691340

IUPAC Name:

5-[(2,4-difluorophenyl)methyl]-2H-tetrazole

InChI:

InChI=1S/C8H6F2N4/c9-6-2-1-5(7(10)4-6)3-8-11-13-14-12-8/h1-2,4H,3H2,(H,11,12,13,14)

InChI Key:

AJSDIMVQQSJLOQ-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)F)Cc1nnn[nH]1

Complexity:

192

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.161g/mol

Monoisotopic Mass:

196.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6