Name: Name:5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-amine
Brand: Angene
SKU: AG019US5
Rating: 90 (10 reviews)

5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-amine

CAS No.:

91643-58-2

Catalog Number:

AG019US5

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

Catalog Number:

AG019US5

Chemical Name:

5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-amine

CAS Number:

91643-58-2

Molecular Formula:

C12H15N3O2

Molecular Weight:

233.2664

MDL Number:

MFCD09939201

IUPAC Name:

5-(4-butoxyphenyl)-1,3,4-oxadiazol-2-amine

InChI:

InChI=1S/C12H15N3O2/c1-2-3-8-16-10-6-4-9(5-7-10)11-14-15-12(13)17-11/h4-7H,2-3,8H2,1H3,(H2,13,15)

InChI Key:

GXIQQCJUWDVEJP-UHFFFAOYSA-N

SMILES:

CCCCOc1ccc(cc1)c1nnc(o1)N

Complexity:

220

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.271g/mol

Monoisotopic Mass:

233.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3