Basic information
- CAS
2141-42-6- Standard SMILES
c1ccc2cc3c(cc2c1)CCCC3- InChIKey
XBDYBAVJXHJMNQ-UHFFFAOYSA-N- Molecular formula
- C14H14
- Average molar mass
- 182.26 g/mol
- Monoisotopic mass
- 182.10955045
Names & identifiers
- Preferred name
- 1,2,3,4-Tetrahydroanthracene
- IUPAC
- 1,2,3,4-tetrahydroanthracene
- English name
- 1,2,3,4-tetrahydroanthracene
- Molecular formula
- C14H14
- Molecular weight
- 182.26096
Names & synonyms
1,2,3,4-Tetrahydroanthracene2141-42-6DTXSID00175681RefChem:1051929DTXCID6098172218-392-9Anthracene, 1,2,3,4-tetrahydro-Anthracene, tetrahydro-EINECS 218-392-9SCHEMBL42412SCHEMBL322056SCHEMBL815811
Show more names
SCHEMBL4919044SCHEMBL6118212SCHEMBL21081756SCHEMBL298076051,2,3,4-Tetrahydroanthracene #NS00026859
Database identifiers
- CAS
2141-42-6- PubChem CID
- 35386
- DTXSID
DTXSID00175681- EC Number
- 218-392-9
- Nikkaji
- J149.666B
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Experimental & physicochemical properties
SpringerMaterials PropertiesFusion temperature
Physicochemical properties
- Melting point
- 103 · 103-105 °C
- Boiling point
- 250.67 °C · 250.67°C (rough estimate)
- Density
- 0.99 · 0.9900 (estimate)
- refractive index
- 1.485 · 1.4850 (estimate)
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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