Basic information
- CAS
612-69-1- Standard SMILES
COc1cc(-c2cc(OC)c(O)c(OC)c2)cc(OC)c1O- InChIKey
NRTOUGPMXLJETQ-UHFFFAOYSA-N- Molecular formula
- C16H18O6
- Average molar mass
- 306.31 g/mol
- Monoisotopic mass
- 306.11033829
Names & identifiers
- Preferred name
- 3,3',5,5'-Tetramethoxy(1,1'-biphenyl)-4,4'-diol
- IUPAC
- 4-(4-hydroxy-3,5-dimethoxyphenyl)-2,6-dimethoxyphenol
- English name
- 3,3',5,5'-Tetramethoxy-1,1'-biphenyl-4,4'-diol
- Molecular formula
- C16H18O6
- Molecular weight
- 306.31
Names & synonyms
612-69-13,3',5,5'-Tetramethoxy(1,1'-biphenyl)-4,4'-diol6ECV5Z5BHS3,3',5,5'-tetramethoxy-4,4'-dihydroxybiphenylNSC-83599DTXSID302101103,3',5,5'-Tetramethoxy[1,1'-biphenyl]-4,4'-diolRefChem:1065514DTXCID30132601HYDROCOERULIGNONE4-(4-hydroxy-3,5-dimethoxyphenyl)-2,6-dimethoxyphenolNSC83599
Show more names
Hydrocerulignone3,3',5,5'-Tetramethoxybiphenyl-4,4'-diol3,3',5,5'-Tetramethoxy-1,1'-biphenyl-4,4'-diol[1,1'-Biphenyl]-4,4'-diol, 3,3',5,5'-tetramethoxy-4-(4-hydroxy-3,5-dimethoxy-phenyl)-2,6-dimethoxy-phenol
UNII-6ECV5Z5BHSNSC 835993,3',5,5'-Tetramethoxy-[1,1'-biphenyl]-4,4'-diolMLS0026945191,1'-Biphenyl, 3,3',5,5'-tetramethoxy-4,4'-dihydroxyTMBPghl.PD_Mitscher_leg0.943SCHEMBL5030552
Database identifiers
- CAS
612-69-1- PubChem CID
- 256604
- DTXSID
DTXSID30210110
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- FDA UNII
- 6 ECV5Z5BHS · 6ECV5Z5BHS
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers6 total
南京唯博特医药科技有限公司18066048793 · [email protected]
上海天时化工有限公司021-57951555 · [email protected]
上海天时化工有限公司+86-021-57951555 +8618017249410 · [email protected]
海蔚化学86-21-51086038 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
Related reactions
0 records
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Compound notes
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