Name: Name:3-[3-(difluoromethoxy)phenyl]-1H-1,2,4-triazol-5-amine
Brand: Angene
SKU: AG01AAHN
Rating: 90 (10 reviews)

3-[3-(difluoromethoxy)phenyl]-1H-1,2,4-triazol-5-amine

CAS No.:

1152533-08-8

Catalog Number:

AG01AAHN

Molecular Formula:

C9H8F2N4O

Molecular Weight:

226.1828

Catalog Number:

AG01AAHN

Chemical Name:

3-[3-(difluoromethoxy)phenyl]-1H-1,2,4-triazol-5-amine

CAS Number:

1152533-08-8

Molecular Formula:

C9H8F2N4O

Molecular Weight:

226.1828

MDL Number:

MFCD17167188

IUPAC Name:

5-[3-(difluoromethoxy)phenyl]-1H-1,2,4-triazol-3-amine

InChI:

InChI=1S/C9H8F2N4O/c10-8(11)16-6-3-1-2-5(4-6)7-13-9(12)15-14-7/h1-4,8H,(H3,12,13,14,15)

InChI Key:

NGZZEOYUZPSFJO-UHFFFAOYSA-N

SMILES:

FC(Oc1cccc(c1)c1n[nH]c(n1)N)F

Complexity:

232

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

226.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

226.187g/mol

Monoisotopic Mass:

226.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2