6,7-Dihydroxynaphthalene-2-carboxylic acid
Basic information
- CAS
113458-95-0- Standard SMILES
O=C(O)c1ccc2cc(O)c(O)cc2c1- InChIKey
NEEWJIPREFDATB-UHFFFAOYSA-N- Molecular formula
- C11H8O4
- Average molar mass
- 204.18 g/mol
- Monoisotopic mass
- 204.04225873
Names & identifiers
- Preferred name
- 6,7-Dihydroxynaphthalene-2-carboxylic acid
- IUPAC
- 6,7-dihydroxynaphthalene-2-carboxylic acid
- English name
- 2-Naphthalenecarboxylic acid, 6,7-dihydroxy- (9CI)
- Molecular formula
- C11H8O4
- Molecular weight
- 204.18
Names & synonyms
113458-95-06,7-Dihydroxy-2-naphthoic acid6,7-dihydroxynaphthalene-2-carboxylic acid2-Naphthalenecarboxylic acid, 6,7-dihydroxy-CHEMBL186302-Naphthalenecarboxylic acid 67-dihydroxy-2-Naphthalenecarboxylic acid, 6,7-dihydroxy- (9CI)SCHEMBL3391297SCHEMBL29779941DTXSID50332808BDBM50057343MFCD18815299
Show more names
6,7-dihydroxy-2-naphthalenecarboxylicacidDB-1185646,7-Dihydroxy-naphthalene-2-carboxylic acidF81705F8615292-?Naphthalenecarboxyli?c acid, 6,?7-?dihydroxy-
Database identifiers
- CAS
113458-95-0- PubChem CID
- 466853
- DTXSID
DTXSID50332808- ChEMBL
CHEMBL18630- Nikkaji
- J1.107.401D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 253
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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