(5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide
TL;DR: (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide (CAS 142328-12-9) is a chemical compound with molecular formula C6H5N3O4 and molecular weight 183.028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-5-hydroxyimino-1-oxido-6,7-dihydro-2,1,3-benzoxadiazol-1-ium-4-one
Also Known As: BAS 00318849, 1-Oxy-6,7-dihydro-benzo[1,2,5]oxadiazole-4,5-dione 5-oxime, (5Z)-5-hydroxyimino-1-oxido-6,7-dihydro-2,1,3-benzoxadiazol-1-ium-4-one, (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide, (Z)-5-(hydroxyimino)-4-oxo-4,5,6,7-tetrahydrobenzo[c][1,2,5]oxadiazole 1-oxide
Technical Specifications
| Molecular Formula | C6H5N3O4 |
| Molecular Weight | 183.028 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.028 Da |
| Heavy Atoms | 13 |
| Complexity | 267.0 |
| SMILES | C\1CC2=[N+](ON=C2C(=O)/C1=N\O)[O-] |
| InChIKey | MAQISRHOCSWQOP-CLTKARDFSA-N |
Chemical Property Profile of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide
Property Insights of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide. Following Lipinski's Rule of Five, (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide?
The CAS number of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide is 142328-12-9.
What is the molecular formula of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide?
The molecular formula of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide is C6H5N3O4.
What is the molecular weight of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide?
The molecular weight of (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide is 183.028 g/mol.
Where can I buy (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide?
You can request a quote for (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide?
Yes, CoreyChem provides custom synthesis services for (5Z)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-one 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.