Name: Name:3-(3-bromo-4-methoxyphenyl)-4,5-dihydro-1,2,4-oxadiazol-5-one
Brand: Angene
SKU: AG01ACEA
Rating: 90 (10 reviews)

3-(3-bromo-4-methoxyphenyl)-4,5-dihydro-1,2,4-oxadiazol-5-one

CAS No.:

1183996-38-4

Catalog Number:

AG01ACEA

Molecular Formula:

C9H7BrN2O3

Molecular Weight:

271.0675

Catalog Number:

AG01ACEA

Chemical Name:

3-(3-bromo-4-methoxyphenyl)-4,5-dihydro-1,2,4-oxadiazol-5-one

CAS Number:

1183996-38-4

Molecular Formula:

C9H7BrN2O3

Molecular Weight:

271.0675

MDL Number:

MFCD12822796

IUPAC Name:

3-(3-bromo-4-methoxyphenyl)-4H-1,2,4-oxadiazol-5-one

InChI:

InChI=1S/C9H7BrN2O3/c1-14-7-3-2-5(4-6(7)10)8-11-9(13)15-12-8/h2-4H,1H3,(H,11,12,13)

InChI Key:

PPOOXLPDIVNENI-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1Br)c1noc(=O)[nH]1

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.964g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.07g/mol

Monoisotopic Mass:

269.964g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1