Name: Name:6-nitro-2,4-dihydro-1H-3,1-benzoxazin-2-one
Brand: Angene
SKU: AG01B26I
Rating: 90 (10 reviews)

6-nitro-2,4-dihydro-1H-3,1-benzoxazin-2-one

CAS No.:

94107-60-5

Catalog Number:

AG01B26I

Molecular Formula:

C8H6N2O4

Molecular Weight:

194.1442

Catalog Number:

AG01B26I

Chemical Name:

6-nitro-2,4-dihydro-1H-3,1-benzoxazin-2-one

CAS Number:

94107-60-5

Molecular Formula:

C8H6N2O4

Molecular Weight:

194.1442

MDL Number:

MFCD22187914

IUPAC Name:

6-nitro-1,4-dihydro-3,1-benzoxazin-2-one

InChI:

InChI=1S/C8H6N2O4/c11-8-9-7-2-1-6(10(12)13)3-5(7)4-14-8/h1-3H,4H2,(H,9,11)

InChI Key:

NLLUNRCIKRPYMQ-UHFFFAOYSA-N

SMILES:

O=C1OCc2c(N1)ccc(c2)[N+](=O)[O-]

EC Number:

302-293-3

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.146g/mol

Monoisotopic Mass:

194.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9