9-But-1-ynyl-10-ethylphenanthrene
Basic information
- CAS
624739-88-4- Standard SMILES
CCC#Cc1c(CC)c2ccccc2c2ccccc12- InChIKey
OLPRADHJTIMKOD-UHFFFAOYSA-N- Molecular formula
- C20H18
- Average molar mass
- 258.4 g/mol
- Monoisotopic mass
- 258.14085057
Names & identifiers
- Preferred name
- 9-But-1-ynyl-10-ethylphenanthrene
- IUPAC
- 9-but-1-ynyl-10-ethylphenanthrene
- English name
- 9-But-1-ynyl-10-ethylphenanthrene
- Molecular formula
- C20H18
- Molecular weight
- 258.36
Names & synonyms
624739-88-49-BUT-1-YNYL-10-ETHYLPHENANTHRENE9-(but-1-yn-1-yl)-10-ethylphenanthreneDTXSID90699664Phenanthrene, 9-(1-butyn-1-yl)-10-ethyl-
Database identifiers
- CAS
624739-88-4- PubChem CID
- 53427875
- DTXSID
DTXSID90699664- Nikkaji
- J1.981.931K
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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