| CAS Number | 134767-55-8 |
| Catalog Number | AG009J9U(AGN-PC-0WO8AU) |
| Chemical Name | 2-Methyl-4,5,6,7-tetrahydrobenzo[d]thiazol-7-ol |
| IUPAC Name | 2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol |
| InChI | InChI=1S/C8H11NOS/c1-5-9-6-3-2-4-7(10)8(6)11-5/h7,10H,2-4H2,1H3 |
| InChI Key | VRMWSMYTTSJLHI-UHFFFAOYSA-N |
| MDL Number | MFCD16679018 |
| Molecular Formula | C8H11NOS |
| Molecular Weight | 169.2440 |
| SMILES | CC=1SC2=C(N1)CCCC2O |
| Synonyms | 2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol,
134767-55-8,
2-methyl-4,5,6,7-tetrahydrobenzo[d]thiazol-7-ol,
AKOS011371083,
MCULE-1246992614,
NE16052,
EN300-75880,
Z1262246117,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.242g/mol |
| Monoisotopic Mass | 169.056g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number