Name: Name:5-[2-(2-chloro-6-fluorophenyl)ethyl]-1H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01AUJH
Rating: 90 (10 reviews)

5-[2-(2-chloro-6-fluorophenyl)ethyl]-1H-1,2,3,4-tetrazole

CAS No.:

1225762-06-0

Catalog Number:

AG01AUJH

Molecular Formula:

C9H8ClFN4

Molecular Weight:

226.6380

Catalog Number:

AG01AUJH

Chemical Name:

5-[2-(2-chloro-6-fluorophenyl)ethyl]-1H-1,2,3,4-tetrazole

CAS Number:

1225762-06-0

Molecular Formula:

C9H8ClFN4

Molecular Weight:

226.6380

MDL Number:

MFCD16314037

IUPAC Name:

5-[2-(2-chloro-6-fluorophenyl)ethyl]-2H-tetrazole

InChI:

InChI=1S/C9H8ClFN4/c10-7-2-1-3-8(11)6(7)4-5-9-12-14-15-13-9/h1-3H,4-5H2,(H,12,13,14,15)

InChI Key:

HASXWOUSLCVRFV-UHFFFAOYSA-N

SMILES:

Fc1cccc(c1CCc1[nH]nnn1)Cl

Complexity:

207

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

226.042g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

226.639g/mol

Monoisotopic Mass:

226.042g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5