methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate

HCID 322602

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 2962-67-6
Standard SMILES: COC(=O)C1CC(=O)c2ccccc2C1c1ccccc1
InChIKey: RBIHASBAKDZTHP-UHFFFAOYSA-N
Molecular formula: C18H16O3
Average molar mass: 280.3 g/mol
Monoisotopic mass: 280.10994437

Names & identifiers

Preferred name: methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate
IUPAC: methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate

Names & synonyms

2962-67-6methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylateNSC280673DTXSID10314100NSC-280673DS-013482Methyl 4-oxo-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4-oxo-1-phenyl-, methyl ester

Database identifiers

CAS: 2962-67-6
PubChem CID: 322602
DTXSID: DTXSID10314100

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 43.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 397

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…