Basic information
- CAS
1625-81-6- Standard SMILES
O=C(O)C1=C(C(=O)O)C2c3ccccc3C1c1ccccc12- InChIKey
AMYJGIMSOTUULB-UHFFFAOYSA-N- Molecular formula
- C18H12O4
- Average molar mass
- 292.3 g/mol
- Monoisotopic mass
- 292.07355886
Names & identifiers
- Preferred name
- 9,10-Dihydro-9,10-ethenoanthracene-11,12-dicarboxylic acid
- IUPAC
- tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13,15-heptaene-15,16-dicarboxylic acid
- English name
- 9,10-Ethenoanthracene-11,12-dicarboxylicacid, 9,10-dihydro-
- Molecular formula
- C18H12O4
- Molecular weight
- 292.28548
Names & synonyms
1625-81-69,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylic acid9,10-Ethenoanthracene-11,12-dicarboxylic acid, 9,10-dihydro-ZNT3KX26DKUNII-ZNT3KX26DKNSC 22089NSC-22089DTXSID90167378RefChem:107497DTXCID9089869InChI=1/C18H12O4/c19-17(20)15-13-9-5-1-2-6-10(9)14(16(15)18(21)22)12-8-4-3-7-11(12)13/h1-8,13-14H,(H,19,20)(H,21,22NSC22089
Show more names
9,10-Ethenoanthracene-11,12-dicarboxylicacid, 9,10-dihydro-
SCHEMBL3186143RCL S244287RCL S261602AKOS0243314189,10-dihydro-9,10-ethenoanthracene-11,12-dicar-boxylic acid9,10-dihydro-9,10-ethenoanthracene-11,12-dicarboxylicacid
Database identifiers
- CAS
1625-81-6- PubChem CID
- 228906
- DTXSID
DTXSID90167378- UNII
- ZNT3KX26DK
- Nikkaji
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 477
Physicochemical properties
- FDA UNII
- 3 KX26DK · ZNT3KX26DK
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
1 records
Compound notes
Loading…