| CAS Number | 568551-25-7 |
| Catalog Number | AG019HLA |
| Chemical Name | 3-Amino-1-(1-methoxypropan-2-yl)thiourea |
| IUPAC Name | 1-amino-3-(1-methoxypropan-2-yl)thiourea |
| InChI | InChI=1S/C5H13N3OS/c1-4(3-9-2)7-5(10)8-6/h4H,3,6H2,1-2H3,(H2,7,8,10) |
| InChI Key | JIMFBCYLGCKKOS-UHFFFAOYSA-N |
| MDL Number | MFCD03966880 |
| Molecular Formula | C5H13N3OS |
| Molecular Weight | 163.2412 |
| SMILES | COCC(NC(NN)=S)C |
| Synonyms | 3-amino-1-(1-methoxypropan-2-yl)thiourea,
N-(2-methoxy-1-methylethyl)hydrazinecarbothioamide,
568551-25-7,
AC1MX3OA,
AC1Q4FIB,
CTK6B0112,
SBB042568,
AKOS000271121,
AKOS016040118,
MCULE-6677734299,
NE12696,
1-amino-3-(1-methoxypropan-2-yl)thiourea,
EN300-03856,
hydrazino[(2-methoxy-isopropyl)amino]methane-1-thione,
ZINC03276834,
CID3759450,
|
| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.239g/mol |
| Monoisotopic Mass | 163.078g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 91.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number