| CAS Number | 184839-20-1 |
| Catalog Number | AG00ACTG(AGN-PC-0L8CNA) |
| Chemical Name | (4-Tert-butyl-1,3-thiazol-2-yl)methanamine |
| IUPAC Name | (4-tert-butyl-1,3-thiazol-2-yl)methanamine |
| InChI | InChI=1S/C8H14N2S/c1-8(2,3)6-5-11-7(4-9)10-6/h5H,4,9H2,1-3H3 |
| InChI Key | COFQRTLOIPDNTM-UHFFFAOYSA-N |
| MDL Number | MFCD05222069 |
| Molecular Formula | C8H14N2S |
| Molecular Weight | 170.2752 |
| SMILES | NCC1=NC(C(C)(C)C)=CS1 |
| Synonyms | (4-tert-butyl-1,3-thiazol-2-yl)methanamine,
184839-20-1,
1-(4-tert-butyl-1,3-thiazol-2-yl)methanamine,
(4-(tert-Butyl)thiazol-2-yl)methanamine,
AC1Q1MC0,
AC1N799H,
SCHEMBL4573687,
ZINC3710559,
AKOS005766512,
MCULE-2083556152,
AJ-45385,
EN300-70044,
Y-1678,
Z1263811710,
CID4274577,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.274g/mol |
| Monoisotopic Mass | 170.088g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number