Name: Name:5-{[4-(trifluoromethyl)phenyl]methyl}-2H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01A0LF
Rating: 90 (10 reviews)

5-{[4-(trifluoromethyl)phenyl]methyl}-2H-1,2,3,4-tetrazole

CAS No.:

874607-04-2

Catalog Number:

AG01A0LF

Molecular Formula:

C9H7F3N4

Molecular Weight:

228.1739

Catalog Number:

AG01A0LF

Chemical Name:

5-{[4-(trifluoromethyl)phenyl]methyl}-2H-1,2,3,4-tetrazole

CAS Number:

874607-04-2

Molecular Formula:

C9H7F3N4

Molecular Weight:

228.1739

MDL Number:

MFCD00973902

IUPAC Name:

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

InChI:

InChI=1S/C9H7F3N4/c10-9(11,12)7-3-1-6(2-4-7)5-8-13-15-16-14-8/h1-4H,5H2,(H,13,14,15,16)

InChI Key:

CGKUXXKMSFJBQY-UHFFFAOYSA-N

SMILES:

FC(c1ccc(cc1)Cc1n[nH]nn1)(F)F

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.178g/mol

Monoisotopic Mass:

228.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3