3,6-Diamino-9-(2-(methoxycarbonyl)phenyl)xanthylium chloride
[6-amino-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]azanium chloride
Also Known As: Rhodamine 123|Rhodamine-123|Rhodamine 123?|rhodamine 110 methyl ester|Rhodamin 123 Chloride|Rhodamine 123 (chloride)|RHODAMINE123|RH 123|Rhodamine 123? (chloride)|AC1L22U1|orb1307801|EINECS 263-687-8|TUFFYSFVSYUHPA-UHFFFAOYSA-M|3,6-Diamino-9-(2-(methoxycarbonyl)phenyl)xanthylium chloride|HY-D0816|CS-7693|3,6-Diamino-9-[2-(methoxycarbonyl)phenyl]xanthylium Chloride|R 302|R 22420|J3.766.031K|C11190|T16743|R-22420,R-302,RH123|EN300-21633980|I14-9675|2-(6-Amino-3-imino-3H-xanthen-9-yl)benzoic acid methyl ester monohydrochloride|Xanthylium, 3,6-diamino-9-[2-(methoxycarbonyl)phenyl]-, chloride (1:1)|6-amino-9-[2-(methoxycarbonyl)phenyl]-3H-xanthen-3-iminium chloride|2-(6-Amino-3-imino-3H-xanthen-9-yl)benzoic acid methyl ester|3,6-Diamino-9-(2-methoxycarbonyl-phenyl)-xanthenylium; chloride|3,6-Diamino-9-[2-(methoxycarbonyl)phenyl]xanthen-10-ium chloride
| Molecular Formula | C21H17ClN2O3 |
|---|---|
| Molecular Weight | 380.09277 g/mol |
| LogP | -0.76 |
| Topological Polar Surface Area | 91.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.09277 |
| Heavy Atoms | 27 |
| Complexity | 1183.6 |
Chemical Identifiers
| CAS Number | 62669-70-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N.[Cl-] |
Product Overview
3,6-Diamino-9-(2-(methoxycarbonyl)phenyl)xanthylium chloride (CAS 62669-70-9), with molecular formula C21H17ClN2O3 and molecular weight 380.09277 g/mol. IUPAC: [6-amino-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]azanium chloride.
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