2,2-bis(2-chloro-5-nitrophenyl)acetonitrile hydrate

CAS: 1272756-60-1

Formula: C14H9Cl2N3O5

SMILES: O.[O-][N+](=O)C1=CC(C(C#N)C2=C(Cl)C=CC(=C2)[N+]([O-])=O)=C(Cl)C=C1

IUPAC: 2,2-bis(2-chloro-5-nitrophenyl)acetonitrile hydrate

InChI: InChI=1S/C14H7Cl2N3O4.H2O/c15-13-3-1-8(18(20)21)5-10(13)12(7-17)11-6-9(19(22)23)2-4-14(11)16;/h1-6,12H;1H2

Composition: C (45.43%), H (2.45%), Cl (19.15%), N (11.35%), O (21.61%)

Molar Mass: 370.14

Atom Count: 33

Heavy Atom Count: 24