(2,2'-Binaphthalene)-1,1',6,6',7,7'-hexol, 8,8'-bis((E)-(hexylimino)methyl)-3,3'-dimethyl-5,5'-bis(1-methylethyl)-
Basic information
- CAS
7356-17-4- Standard SMILES
CCCCCCN=Cc1c(O)c(O)c(C(C)C)c2cc(C)c(-c3c(C)cc4c(C(C)C)c(O)c(O)c(C=NCCCCCC)c4c3O)c(O)c12- InChIKey
RQWKQNOBDCCPSZ-UHFFFAOYSA-N- Molecular formula
- C42H56N2O6
- Average molar mass
- 684.9 g/mol
- Monoisotopic mass
- 684.41383751
Names & identifiers
- Preferred name
- (2,2'-Binaphthalene)-1,1',6,6',7,7'-hexol, 8,8'-bis((E)-(hexylimino)methyl)-3,3'-dimethyl-5,5'-bis(1-methylethyl)-
- IUPAC
- 8-(hexyliminomethyl)-2-[8-(hexyliminomethyl)-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl]-3-methyl-5-propan-2-ylnaphthalene-1,6,7-triol
Names & synonyms
NSC11983NSC 119837356-17-4(2,2'-Binaphthalene)-1,1',6,6',7,7'-hexol, 8,8'-bis((E)-(hexylimino)methyl)-3,3'-dimethyl-5,5'-bis(1-methylethyl)-[2,2'-Binaphthalene]-1,1',6,6',7,7'-hexol, 8,8'-bis[(E)-(hexylimino)methyl]-3,3'-dimethyl-5,5'-bis(1-methylethyl)-NSC-119838-[(E)-hexyliminomethyl]-2-[8-[(E)-hexyliminomethyl]-1,6,7-trihydroxy-5-isopropyl-3-methyl-2-naphthyl]-5-isopropyl-3-methyl-naphthalene-1,6,7-triol
Database identifiers
- CAS
7356-17-4- PubChem CID
- 223891
Properties
Computed structural properties
- XLogP
- 10.7
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 987
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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