Name: Name:[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine
Brand: Angene
SKU: AG019XG4
Rating: 90 (10 reviews)

[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine

CAS No.:

1152815-26-3

Catalog Number:

AG019XG4

Molecular Formula:

C13H14F3N3

Molecular Weight:

269.2656

Catalog Number:

AG019XG4

Chemical Name:

[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine

CAS Number:

1152815-26-3

Molecular Formula:

C13H14F3N3

Molecular Weight:

269.2656

MDL Number:

MFCD12739104

IUPAC Name:

[4-(3,5-dimethylpyrazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine

InChI:

InChI=1S/C13H14F3N3/c1-8-5-9(2)19(18-8)11-4-3-10(7-17)12(6-11)13(14,15)16/h3-6H,7,17H2,1-2H3

InChI Key:

HVVADCGPMJHVHO-UHFFFAOYSA-N

SMILES:

NCc1ccc(cc1C(F)(F)F)n1nc(cc1C)C

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.271g/mol

Monoisotopic Mass:

269.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4