Basic information
- CAS
61959-33-9- Standard SMILES
O=C(O)c1ccccc1C(=O)c1ccc2c(c1)CCCC2- InChIKey
HVCVQWLJNZXBHT-UHFFFAOYSA-N- Molecular formula
- C18H16O3
- Average molar mass
- 280.3 g/mol
- Monoisotopic mass
- 280.10994437
Names & identifiers
- Preferred name
- ST50981083
- IUPAC
- 2-(5,6,7,8-tetrahydronaphthalene-2-carbonyl)benzoic acid
Names & synonyms
61959-33-9ST50981083DTXSID90402958RefChem:381725DTXCID703538132-(5,6,7,8-tetrahydronaphthalene-2-carbonyl)benzoic AcidBenzoic acid, 2-[(5,6,7,8-tetrahydro-2-naphthalenyl)carbonyl]-Oprea1_598317SCHEMBL12877794HVCVQWLJNZXBHT-UHFFFAOYSA-NAKOS0092364812-(2-5,6,7,8-tetrahydronaphthylcarbonyl)benzoic acid
Show more names
2-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonyl)benzoic acid
Database identifiers
- CAS
61959-33-9- PubChem CID
- 4409400
- DTXSID
DTXSID90402958
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 403
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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