| CAS Number | 890013-64-6 |
| Catalog Number | AG01A7OE(AGN-PC-0WO8P4) |
| Chemical Name | 5-hydrazinyl-2-(2-methylpropyl)-1,3-oxazole-4-carbonitrile |
| IUPAC Name | 5-hydrazinyl-2-(2-methylpropyl)-1,3-oxazole-4-carbonitrile |
| InChI | InChI=1S/C8H12N4O/c1-5(2)3-7-11-6(4-9)8(12-10)13-7/h5,12H,3,10H2,1-2H3 |
| InChI Key | WMNAFMQCYLBDIF-UHFFFAOYSA-N |
| MDL Number | MFCD03444385 |
| Molecular Formula | C8H12N4O |
| Molecular Weight | 180.2071 |
| SMILES | CC(CC1OC(NN)=C(C#N)N=1)C |
| Synonyms | 5-hydrazinyl-2-(2-methylpropyl)-1,3-oxazole-4-carbonitrile,
890013-64-6,
5-hydrazino-2-(2-methylpropyl)-1,3-oxazole-4-carbonitrile,
AC1NHAAE,
AC1Q1P99,
CTK7F1900,
ZINC6883841,
SBB039169,
STL215949,
AKOS000267259,
MCULE-4164829422,
NE25198,
ST45239074,
EN300-59337,
CID4736959,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.211g/mol |
| Monoisotopic Mass | 180.101g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 87.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number