Basic information
- CAS
195-64-2- Standard SMILES
c1ccc2c(c1)ccc1ccc3c(c12)OCO3- InChIKey
NLXUFSGVIVZMBT-UHFFFAOYSA-N- Molecular formula
- C15H10O2
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.06807956
Names & identifiers
- Preferred name
- Naphtho[2,1-g][1,3]benzodioxole
- IUPAC
- naphtho[2,1-g][1,3]benzodioxole
- English name
- 4-Hydroxy-2-mercapto-6-methylpyrimidine
- Molecular formula
- C15H10O2
- Molecular weight
- 222.24
Names & synonyms
naphtho[2,1-g][1,3]benzodioxole195-64-23.4-MethylendioxyphenanthrenPhenanthro[3,4-d]-1,3-dioxole3,4-[methylenebis(oxy)]-Phenanthrene4-Hydroxy-2-mercapto-6-methylpyrimidine USP/EP/BP
Database identifiers
- CAS
195-64-2- PubChem CID
- 11806264
- Nikkaji
- J1.123.346E
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- FDA UNII
- 24888 U5F · QW24888U5F
Chemistry & industry
Suppliers3 total
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
郑州灵之悦科技有限公司+86-0371-55074660 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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