4-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethyl-butyl]-1,2-dimethoxy-benzene
Basic information
- Standard SMILES
COc1ccc(C[C@@H](C)[C@H](C)Cc2ccc(OC)c(OC)c2)cc1OC- InChIKey
ORQFDHFZSMXRLM-HZPDHXFCSA-N- Molecular formula
- C22H30O4
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.21440944
Names & identifiers
- Preferred name
- 4-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethyl-butyl]-1,2-dimethoxy-benzene
- IUPAC
- 4-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
Names & synonyms
SCHEMBL100601644-[(2R,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethyl-butyl]-1,2-dimethoxy-benzenemeso-1,4-bis(3,4-Dimethoxyphenyl)-(2R,3S)-dimethylbutane tetra-O-methylnor-dihydroguaiaretic acid, tetra-O-methyl-NDGA
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
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Compound notes
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