Anthracene-maleic anhydride diels-alder adduct
Basic information
- CAS
5443-16-3- Standard SMILES
O=C1OC(=O)C2C3c4ccccc4C(c4ccccc43)C12- InChIKey
PSKVQQJLLWSBFV-UHFFFAOYSA-N- Molecular formula
- C18H12O3
- Average molar mass
- 276.3 g/mol
Overview
See other relationships...
Names & identifiers
- Preferred name
- Anthracene-maleic anhydride diels-alder adduct
- IUPAC
- 17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
- English name
- Nsc13695
- Molecular formula
- C18H12O3
- Molecular weight
- 276.29
Names & synonyms
RefChem:10770385443-16-317-oxapentacyclo[6.6.5.0(2,7).0(9,14).0(15,19)]-nonadeca-2,4,6,9,11,13-hexaene-16,18-dione9,10-Dihydro-9,10-[3,4]furanoanthracene-12,14-dioneNSC1369517-oxapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dioneMFCD0015242717-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dioneRCL S5973117-oxapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9(14),10,12-hexaene-16,18-dione9,10-Dihydroanthraceno-9,10-endo-.alpha.,.beta.-succinic anhydride17-Oxapentacyclo[6.6.5.0(2,7).0(9,14).0(15,19)]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Show more names
Anthracene-maleic anhydride diels-alder adductAnthracene, 2,5-furandione adductAnthracene,maleic anhydride adduct9,10-dihydro-9,10-[3,4]furanthracene-12,14-dioneEndo-9,10-(.alpha.,.beta.-succinic anhydride)anthracene
orb2280009SCHEMBL7194511SCHEMBL30754024PSKVQQJLLWSBFV-UHFFFAOYSA-N9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboxylic anhydrideALBB-012785RCL S261629NSC 13695
Database identifiers
- CAS
5443-16-3- PubChem CID
- 138503
- Nikkaji
- J3.693.491C、J432.121I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 431
Physicochemical properties
- Melting point
- 267 · 267-268 °C
- Boiling point
- 492.7 · 492.7±45.0 °C(Predicted)
- Density
- 1.391 g/cm3 · 1.391 g/cm3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
- HS Code
- 2932990090 · 2932990090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Related reactions
0 records
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Compound notes
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