| CAS Number | 1017211-92-5 |
| Catalog Number | AG01AB0D(AGN-PC-0WOBI4) |
| Chemical Name | 1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine |
| IUPAC Name | 1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine |
| InChI | InChI=1S/C7H12N2S/c1-3-6(8)7-9-5(2)4-10-7/h4,6H,3,8H2,1-2H3 |
| InChI Key | BTVXNMJCZCLBTP-UHFFFAOYSA-N |
| MDL Number | MFCD09891374 |
| Molecular Formula | C7H12N2S |
| Molecular Weight | 156.2486 |
| SMILES | CCC(C1SC=C(C)N=1)N |
| Synonyms | 1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine,
1017211-92-5,
AC1Q2SJ3,
AKOS010591759,
MCULE-5686980610,
NE26184,
EN300-70087,
Z1263811750,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.247g/mol |
| Monoisotopic Mass | 156.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number