Keyword(s): | Food Contact Chemicals |
Molecule Category | Free-form |
UNII | H691WBT7OS |
EPA CompTox | DTXSID7043748 |
InChI Key | XIWMTQIUUWJNRP-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C6H8N2O1 | |
Molecular Weight | 124.06 | |
AlogP | 0.56 | |
Hydrogen Bond Acceptor | 3.0 | |
Hydrogen Bond Donor | 3.0 | |
Number of Rotational Bond | 0.0 | |
Polar Surface Area | 72.27 | |
Molecular species | None | |
Aromatic Rings | 1.0 | |
Heavy Atoms | 9.0 |
Resources | Reference | |
---|---|---|
CAS NUMBER | 95-86-3 | |
NORMAN SUSDAT | ||
FDA SRS | H691WBT7OS | |
PubChem | 7266 | |
ChemSpider | 6996.0 |