| CAS Number | 1155909-82-2 |
| Catalog Number | AG01A96S(AGN-PC-0WO3CK) |
| Chemical Name | 2-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]aniline |
| IUPAC Name | 2-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]aniline |
| InChI | InChI=1S/C11H12N2S2/c1-7-5-9(3-4-10(7)12)15-11-13-8(2)6-14-11/h3-6H,12H2,1-2H3 |
| InChI Key | KIGOAFGNFGUNGG-UHFFFAOYSA-N |
| MDL Number | MFCD12169276 |
| Molecular Formula | C11H12N2S2 |
| Molecular Weight | 236.3564 |
| SMILES | CC1N=C(SC2=CC(C)=C(N)C=C2)SC=1 |
| Synonyms | 2-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]aniline,
1155909-82-2,
AC1Q2OO6,
ZINC35278605,
AKOS009471290,
MCULE-6270564750,
NE35780,
EN300-64335,
Z933269074,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.351g/mol |
| Monoisotopic Mass | 236.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 92.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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Certificate of Analysis
Lot Number