| CAS Number | 1340124-15-3 |
| Catalog Number | AG00IVI3(AGN-PC-0WB2F6) |
| Chemical Name | 5-bromo-N,N-diethyl-1,3,4-thiadiazol-2-amine |
| IUPAC Name | 5-bromo-N,N-diethyl-1,3,4-thiadiazol-2-amine |
| InChI | InChI=1S/C6H10BrN3S/c1-3-10(4-2)6-9-8-5(7)11-6/h3-4H2,1-2H3 |
| InChI Key | FGYQDBJISVECEF-UHFFFAOYSA-N |
| MDL Number | MFCD20368504 |
| Molecular Formula | C6H10BrN3S |
| Molecular Weight | 236.1327 |
| SMILES | [Br]C=1(SC(N(CC)CC)=NN=1) |
| Synonyms | 5-bromo-N,N-diethyl-1,3,4-thiadiazol-2-amine,
1340124-15-3,
bromoNNdiethylthiadiazolamine,
MFCD20368504,
ZINC72115338,
AKOS013950815,
MCULE-2409861765,
NF-0055,
RP13546,
KS-000029S1,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.978g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.131g/mol |
| Monoisotopic Mass | 234.978g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 57.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number