| CAS Number | 420120-01-0 |
| Catalog Number | AG01A9T6 |
| Chemical Name | 1-(4-Isopropoxyphenyl)thiourea |
| IUPAC Name | (4-propan-2-yloxyphenyl)thiourea |
| InChI | InChI=1S/C10H14N2OS/c1-7(2)13-9-5-3-8(4-6-9)12-10(11)14/h3-7H,1-2H3,(H3,11,12,14) |
| InChI Key | NFOHIBCWZCPLRB-UHFFFAOYSA-N |
| MDL Number | MFCD11202364 |
| Molecular Formula | C10H14N2OS |
| Molecular Weight | 210.2960 |
| SMILES | S=C(N)NC1=CC=C(OC(C)C)C=C1 |
| Synonyms | [4-(propan-2-yloxy)phenyl]thiourea,
420120-01-0,
AC1Q1QPL,
SCHEMBL19628504,
ZINC20586257,
AKOS009280140,
NE41623,
EN300-66061,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.295g/mol |
| Monoisotopic Mass | 210.083g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 79.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number