| CAS Number | 1334490-02-6 |
| Catalog Number | AG00J2MN |
| Chemical Name | 4-(1,3-benzodioxol-5-yl)-2-hydrazinopyrimidine |
| IUPAC Name | [4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]hydrazine |
| InChI | InChI=1S/C11H10N4O2/c12-15-11-13-4-3-8(14-11)7-1-2-9-10(5-7)17-6-16-9/h1-5H,6,12H2,(H,13,14,15) |
| InChI Key | KIAOTMHMGZWUGY-UHFFFAOYSA-N |
| MDL Number | MFCD03768184 |
| Molecular Formula | C11H10N4O2 |
| Molecular Weight | 230.2227 |
| SMILES | N1C(=CC=NC=1NN)C1C=CC2=C(OCO2)C=1 |
| Synonyms | 4-(1,3-Benzodioxol-5-yl)-2-hydrazinopyrimidine,
1334490-02-6,
4-(Benzo[d][1,3]dioxol-5-yl)-2-hydrazinylpyrimidine,
ZX-CM010135,
MFCD20231853,
ZINC72417400,
AKOS015868465,
MCULE-4743686241,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.227g/mol |
| Monoisotopic Mass | 230.08g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 82.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number