| CAS Number | 871548-20-8 |
| Catalog Number | AG019OQT |
| Chemical Name | (2-Ethyl-6-methylphenyl)thiourea |
| IUPAC Name | (2-ethyl-6-methylphenyl)thiourea |
| InChI | InChI=1S/C10H14N2S/c1-3-8-6-4-5-7(2)9(8)12-10(11)13/h4-6H,3H2,1-2H3,(H3,11,12,13) |
| InChI Key | NOTVQPRXZSXDAY-UHFFFAOYSA-N |
| MDL Number | MFCD07352237 |
| Molecular Formula | C10H14N2S |
| Molecular Weight | 194.2966 |
| SMILES | CCC1=C(NC(N)=S)C(C)=CC=C1 |
| Synonyms | (2-ethyl-6-methylphenyl)thiourea,
N-(2-ethyl-6-methylphenyl)thiourea,
871548-20-8,
AC1OEVYJ,
AC1Q2T4D,
SCHEMBL5520049,
CTK6D2131,
NOTVQPRXZSXDAY-UHFFFAOYSA-N,
ZINC3888920,
1-(2-ethyl-6-methylphenyl)thiourea,
AKOS009037272,
N-(2-Ethyl-6-methylphenyl)-thiourea,
MCULE-2478532676,
NE13583,
EN300-14925,
J-522906,
Z111874730,
ZINC03888920,
CID7064048,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.296g/mol |
| Monoisotopic Mass | 194.088g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number