Name: Name:7-(4-Methoxybenzylamino)-4-nitrobenzoxadiazole
Brand: Angene
SKU: AG007HZZ
Rating: 90 (10 reviews)

7-(4-Methoxybenzylamino)-4-nitrobenzoxadiazole

CAS No.:

33984-50-8

Catalog Number:

AG007HZZ

Molecular Formula:

C14H12N4O4

Molecular Weight:

300.2695

Catalog Number:

AG007HZZ

Chemical Name:

7-(4-Methoxybenzylamino)-4-nitrobenzoxadiazole

CAS Number:

33984-50-8

Molecular Formula:

C14H12N4O4

Molecular Weight:

300.2695

MDL Number:

MFCD00042778

IUPAC Name:

N-[(4-methoxyphenyl)methyl]-4-nitro-2,1,3-benzoxadiazol-7-amine

InChI:

InChI=1S/C14H12N4O4/c1-21-10-4-2-9(3-5-10)8-15-11-6-7-12(18(19)20)14-13(11)16-22-17-14/h2-7,15H,8H2,1H3

InChI Key:

IENONFJSMWUIQQ-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)CNc1ccc(c2c1onn2)[N+](=O)[O-]

EC Number:

251-775-9

NSC Number:

240872

Complexity:

384

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

300.086g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

300.274g/mol

Monoisotopic Mass:

300.086g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

106A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5