Basic information
- CAS
63642-50-2- Standard SMILES
O=C1CCCc2c1ccc1c2ccc2ccccc21- InChIKey
ZVYZDXRSPQXUIS-UHFFFAOYSA-N- Molecular formula
- C18H14O
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.10446507
Names & identifiers
- Preferred name
- 1(2H)-Chrysenone, 3,4-dihydro-
- IUPAC
- 3,4-dihydro-2H-chrysen-1-one
- English name
- 1,2,3,4-TETRAHYDROCHRYSEN-1-ONE
- Molecular formula
- C18H14O
- Molecular weight
- 246.3
Names & synonyms
1,2,3,4-Tetrahydrochrysene-1-one3,4-Dihydro-1(2H)-chrysenone63642-50-21(2H)-CHRYSENONE, 3,4-DIHYDRO-BRN 18824503,4-Dihydrochrysen-1(2H)-one1,2,3,4-TETRAHYDROCHRYSEN-1-ONEGZ9R68ZUL74-07-00-01793 (Beilstein Handbook Reference)SCHEMBL27463276DTXSID00213017AKOS015905130
Show more names
Tetrahydrochrysene-1-one, 1,2,3,4-DB-215758
Database identifiers
- CAS
63642-50-2- PubChem CID
- 44588
- DTXSID
DTXSID00213017- UNII
- GZ9R68ZUL7
- Nikkaji
- J69.541F
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 361
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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