Completing data — usually done within a minute
Basic information
- CAS
66217-21-8- Standard SMILES
CCCCCCOc1ccc2cc(Br)ccc2c1- InChIKey
JBNWDSSVOCTJBL-UHFFFAOYSA-N- Molecular formula
- C16H19BrO
- Average molar mass
- 307.22 g/mol
- Monoisotopic mass
- 306.06192733
Names & identifiers
- Preferred name
- 2-Bromo-6-(hexyloxy)naphthalene
- IUPAC
- 2-bromo-6-hexoxynaphthalene
Names & synonyms
2-Bromo-6-(hexyloxy)naphthalene66217-21-8Naphthalene, 2-bromo-6-(hexyloxy)-SCHEMBL4748293DTXSID60404040JBNWDSSVOCTJBL-UHFFFAOYSA-NAKOS012837606DA-26763SR-01000388853SR-01000388853-1
Database identifiers
- CAS
66217-21-8- PubChem CID
- 4535583
- DTXSID
DTXSID60404040- Nikkaji
- J3.297.208J
Properties
Computed structural propertiesFilling in
- XLogP
- 6.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 231
Chemistry & industry
Suppliers2 total
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
南京美韬医药科技有限公司[email protected] · [email protected]
Related reactions
3 records
Compound notes
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