New methylene blue
ethyl-[7-(ethylamino)-2,8-dimethylphenothiazin-3-ylidene]azanium chloride
| Molecular Formula | C18H22ClN3S |
|---|---|
| Molecular Weight | 347.9 g/mol |
| Topological Polar Surface Area | 63.7 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.12228 |
| Heavy Atoms | 23 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 1934-16-3 |
|---|---|
| SMILES | CCNC1=CC2=C(C=C1C)N=C3C=C(C(=[NH+]CC)C=C3S2)C.[Cl-] |
| InChIKey | SQHOAFZGYFNDQX-UHFFFAOYSA-N |
📖 Product Overview
New methylene blue (CAS: 1934-16-3) is a chemical compound with molecular formula C18H22ClN3S and molecular weight 347.9 g/mol. Its IUPAC systematic name is ethyl-[7-(ethylamino)-2,8-dimethylphenothiazin-3-ylidene]azanium chloride.
SQHOAFZGYFNDQX-UHFFFAOYSA-N.
SMILES: CCNC1=CC2=C(C=C1C)N=C3C=C(C(=[NH+]CC)C=C3S2)C.[Cl-].
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