| CAS Number | 1039924-20-3 |
| Catalog Number | AG01A9T7 |
| Chemical Name | 3-Amino-1-[2-(propan-2-yl)phenyl]thiourea |
| IUPAC Name | 1-amino-3-(2-propan-2-ylphenyl)thiourea |
| InChI | InChI=1S/C10H15N3S/c1-7(2)8-5-3-4-6-9(8)12-10(14)13-11/h3-7H,11H2,1-2H3,(H2,12,13,14) |
| InChI Key | OHSGYRCXZGEYHU-UHFFFAOYSA-N |
| MDL Number | MFCD11188561 |
| Molecular Formula | C10H15N3S |
| Molecular Weight | 209.3112 |
| SMILES | CC(C1=C(NC(NN)=S)C=CC=C1)C |
| Synonyms | 3-amino-1-[2-(propan-2-yl)phenyl]thiourea,
1039924-20-3,
EN300-66062,
AC1Q1OF2,
SCHEMBL15165726,
ZINC20426673,
BBV-222118,
FCH5458723,
NE37712,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.311g/mol |
| Monoisotopic Mass | 209.099g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 82.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number