Name: Name:4(1H)-Quinazolinone, 2-chloro-6-nitro-
Brand: Angene
SKU: AG0054DP
Rating: 90 (10 reviews)

4(1H)-Quinazolinone, 2-chloro-6-nitro-

CAS No.:

80195-33-1

Catalog Number:

AG0054DP

Molecular Formula:

C8H4ClN3O3

Molecular Weight:

225.5887

Catalog Number:

AG0054DP

Chemical Name:

4(1H)-Quinazolinone, 2-chloro-6-nitro-

CAS Number:

80195-33-1

Molecular Formula:

C8H4ClN3O3

Molecular Weight:

225.5887

IUPAC Name:

2-chloro-6-nitro-3H-quinazolin-4-one

InChI:

InChI=1S/C8H4ClN3O3/c9-8-10-6-2-1-4(12(14)15)3-5(6)7(13)11-8/h1-3H,(H,10,11,13)

InChI Key:

MLJRXYMXBVELPQ-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccc2c(c1)c(=O)nc([nH]2)Cl

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.994g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.588g/mol

Monoisotopic Mass:

224.994g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6