| CAS Number | 120739-61-9 |
| Catalog Number | AG00IRG7(AGN-PC-0KZ5QB) |
| Chemical Name | 1,1-dimethyl-2-[1-(methylsulfanyl)-2-nitrovinyl]hydrazine |
| IUPAC Name | 1,1-dimethyl-2-(1-methylsulfanyl-2-nitroethenyl)hydrazine |
| InChI | InChI=1S/C5H11N3O2S/c1-7(2)6-5(11-3)4-8(9)10/h4,6H,1-3H3 |
| InChI Key | QAUBTIIOIQMXCV-UHFFFAOYSA-N |
| MDL Number | MFCD00138258 |
| Molecular Formula | C5H11N3O2S |
| Molecular Weight | 177.2247 |
| SMILES | S(C(NN(C)C)=C[N+](=O)[O-])C |
| Synonyms | 120739-61-9,
1,1-dimethyl-2-[1-(methylsulfanyl)-2-nitrovinyl]hydrazine,
AC1MWEGP,
1,1-dimethyl-2-[(Z)-1-(methylsulfanyl)-2-nitroethenyl]hydrazine,
SCHEMBL7665139,
KS-00001UAL,
AKOS030240309,
MCULE-6789882556,
1,1-dimethyl-2-(1-methylsulfanyl-2-nitroethenyl)hydrazine,
ZINC03210020,
CID3722803,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.222g/mol |
| Monoisotopic Mass | 177.057g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 86.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number