| CAS Number | 1234615-84-9 |
| Catalog Number | AG00HHA1(AGN-PC-0WB66W) |
| Chemical Name | 5-(1,2-di-boc-hydrazino)pyrimidine |
| IUPAC Name | tert-butyl N-[(2-methylpropan-2-yl)oxycarbonylamino]-N-pyrimidin-5-ylcarbamate |
| InChI | InChI=1S/C14H22N4O4/c1-13(2,3)21-11(19)17-18(10-7-15-9-16-8-10)12(20)22-14(4,5)6/h7-9H,1-6H3,(H,17,19) |
| InChI Key | DXJVUWWLMCSKTA-UHFFFAOYSA-N |
| MDL Number | MFCD17168406 |
| Molecular Formula | C14H22N4O4 |
| Molecular Weight | 310.3489 |
| SMILES | C(=O)(OC(C)(C)C)N(C1C=NC=NC=1)NC(=O)OC(C)(C)C |
| Synonyms | 1234615-84-9,
5-(1,2-DI-BOC-HYDRAZINO)PYRIMIDINE,
Di-tert-butyl 1-(pyrimidin-5-yl)hydrazine-1,2-dicarboxylate,
di-tert-Butyl 1-(5-pyrimidinyl)-1,2-hydrazinedicarboxylate,
SCHEMBL16398247,
DXJVUWWLMCSKTA-UHFFFAOYSA-N,
ZX-CM010901,
MFCD17168406,
ZINC95346853,
AKOS027254153,
FCH2787502,
PB33397,
AS-51209,
CS-0055190,
Q-2395,
N'-[(tert-Butoxy)carbonyl]-N-(pyrimidin-5-yl)(tert-butoxy)carbohydrazide,
|
| Complexity | 395 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 310.164g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.354g/mol |
| Monoisotopic Mass | 310.164g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 93.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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Certificate of Analysis
Lot Number