Name: Name:1,2,4-OXADIAZOL-5-AMINE, 3-[4-(TRIFLUOROMETHYL)PHENYL]-
Brand: Angene
SKU: AG01DYMC
Rating: 90 (10 reviews)

1,2,4-OXADIAZOL-5-AMINE, 3-[4-(TRIFLUOROMETHYL)PHENYL]-

CAS No.:

1260886-71-2

Catalog Number:

AG01DYMC

Molecular Formula:

C9H6F3N3O

Molecular Weight:

229.1586

Catalog Number:

AG01DYMC

Chemical Name:

1,2,4-OXADIAZOL-5-AMINE, 3-[4-(TRIFLUOROMETHYL)PHENYL]-

CAS Number:

1260886-71-2

Molecular Formula:

C9H6F3N3O

Molecular Weight:

229.1586

MDL Number:

MFCD15526842

IUPAC Name:

3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-amine

InChI:

InChI=1S/C9H6F3N3O/c10-9(11,12)6-3-1-5(2-4-6)7-14-8(13)16-15-7/h1-4H,(H2,13,14,15)

InChI Key:

PVYMOZGDTOTSAC-UHFFFAOYSA-N

SMILES:

Nc1onc(n1)c1ccc(cc1)C(F)(F)F

Complexity:

241

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.162g/mol

Monoisotopic Mass:

229.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3