Pinacryptol yellow

• CAS: 25910-85-4
• Catalog Number: ACM25910854
• Category: Organic & Printed Electronics
• Molecular Weight: 446.5g/mol
• Molecular Formula: C21H22N2O7S
• Synonyms: 6-ethoxy-1-methyl-2-[2-(3-nitrophenyl)ethenyl]-quinoliniumethylsulfate;PKY;PINACRYPTOL YELLOW;PINAKRYPTOL YELLOW;PINAKRYTOL YELLOW;PINA(R) CRYPTOL YELLOW;6-ETHOXY-1-METHYL-2[2-(3-NITROPHENYL)ETHENYL] QUINOLINIUM METHYL SULFATE;6-ETHOXY-1-METHYL-2-(3-NITRO
• IUPAC Name: 6-ethoxy-1-methyl-2-[(E)-2-(3-nitrophenyl)ethenyl]quinolin-1-ium;methyl sulfate
• Canonical SMILES: CCOC1=CC2=C(C=C1)[N+](=C(C=C2)C=CC3=CC(=CC=C3)[N+](=O)[O-])C.COS(=O)(=O)[O-]
• InChI: InChI=1S/C20H19N2O3.CH4O4S/c1-3-25-19-11-12-20-16(14-19)8-10-17(21(20)2)9-7-15-5-4-6-18(13-15)22(23)24;1-5-6(2,3)4/h4-14H,3H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/b9-7+
• InChI Key: ZXQHSPWBYMLHLB-BXTVWIJMSA-M
• Complexity: 567
• Covalently-Bonded Unit Count: 2
• EC Number: 247-336-6
• Exact Mass: 446.114772g/mol
• Formal Charge: 0
• H-Bond Acceptor: 7
• H-Bond Donor: 0
• Heavy Atom Count: 31
• Monoisotopic Mass: 446.114772g/mol
• Rotatable Bond Count: 4