| CAS Number | 73025-93-1 |
| Catalog Number | AG005N1S(AGN-PC-023CDO) |
| Chemical Name | 10H-Phenothiazine, 10-hexyl- |
| IUPAC Name | 10-hexylphenothiazine |
| InChI | InChI=1S/C18H21NS/c1-2-3-4-9-14-19-15-10-5-7-12-17(15)20-18-13-8-6-11-16(18)19/h5-8,10-13H,2-4,9,14H2,1H3 |
| InChI Key | VRJVOTTZESKWPD-UHFFFAOYSA-N |
| MDL Number | MFCD30531810 |
| Molecular Formula | C18H21NS |
| Molecular Weight | 283.4310 |
| SMILES | C(CCCCC)N1C2=CC=CC=C2SC=2C=CC=CC12 |
| Synonyms | 10-Hexyl-10H-phenothiazine,
73025-93-1,
10-hexyl-phenothiazine,
10-HEXYLPHENOTHIAZINE,
SCHEMBL7397164,
10H-Phenothiazine, 10-hexyl-,
CTK2H1826,
DTXSID60597007,
VRJVOTTZESKWPD-UHFFFAOYSA-N,
H1608,
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| Complexity | 271 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.139g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.433g/mol |
| Monoisotopic Mass | 283.139g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 28.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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