Name: Name:3-(phenoxymethyl)-4H-1,2,4-triazole
Brand: Angene
SKU: AG01EINP
Rating: 90 (10 reviews)

3-(phenoxymethyl)-4H-1,2,4-triazole

CAS No.:

856861-91-1

Catalog Number:

AG01EINP

Molecular Formula:

C9H9N3O

Molecular Weight:

175.1873

Catalog Number:

AG01EINP

Chemical Name:

3-(phenoxymethyl)-4H-1,2,4-triazole

CAS Number:

856861-91-1

Molecular Formula:

C9H9N3O

Molecular Weight:

175.1873

MDL Number:

MFCD31665176

IUPAC Name:

5-(phenoxymethyl)-1H-1,2,4-triazole

InChI:

InChI=1S/C9H9N3O/c1-2-4-8(5-3-1)13-6-9-10-7-11-12-9/h1-5,7H,6H2,(H,10,11,12)

InChI Key:

LEAPHQOZVRNMOX-UHFFFAOYSA-N

SMILES:

c1ccc(cc1)OCc1nnc[nH]1

Complexity:

148

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.191g/mol

Monoisotopic Mass:

175.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

50.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5