Name: Name:4-(1H-1,2,4-triazol-1-yl)-3-(trifluoromethyl)aniline
Brand: Angene
SKU: AG01A8NR
Rating: 90 (10 reviews)

4-(1H-1,2,4-triazol-1-yl)-3-(trifluoromethyl)aniline

CAS No.:

351325-27-4

Catalog Number:

AG01A8NR

Molecular Formula:

C9H7F3N4

Molecular Weight:

228.1739

Catalog Number:

AG01A8NR

Chemical Name:

4-(1H-1,2,4-triazol-1-yl)-3-(trifluoromethyl)aniline

CAS Number:

351325-27-4

Molecular Formula:

C9H7F3N4

Molecular Weight:

228.1739

MDL Number:

MFCD12768357

IUPAC Name:

4-(1,2,4-triazol-1-yl)-3-(trifluoromethyl)aniline

InChI:

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

InChI Key:

JZVZWJBLEPZALK-UHFFFAOYSA-N

SMILES:

Nc1ccc(c(c1)C(F)(F)F)n1cncn1

Complexity:

245

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:

56.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9