2,3-Dihydroxy-1,4-benzenedicarboxylic acid
Properties
- Molecular formula
- C8H6O6
- Molar mass
- 198.13 g/mol
- Exact mass
- 198.0164 Da
- Melting point
- 293 °C
- logP
- 0.49Crippen estimate
- Polar surface area
- 115.1 Ų
- H-bond donors / acceptors
- 4 / 4
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
19829-72-2SMILES
O=C(O)c1ccc(C(=O)O)c(O)c1OInChIKey
OHLSHRJUBRUKAN-UHFFFAOYSA-NInChI
InChI=1S/C8H6O6/c9-5-3(7(11)12)1-2-4(6(5)10)8(13)14/h1-2,9-10H,(H,11,12)(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 1,4-Benzenedicarboxylic acid, 2,3-dihydroxy-
- Terephthalic acid, 2,3-dihydroxy-
- 2,3-Dihydroxyterephthalic acid
- NSC 38869
- 2,3-Dihydroxy-p-benzenediacetic acid
Work with 2,3-Dihydroxy-1,4-benzenedicarboxylic acid
Similar compounds
2,3,4-Trihydroxybenzoic acid610-02-679 % similar
2-Hydroxy-1,3-benzenedicarboxylic acid606-19-974 % similar
1,4,5,8-Naphthalenetetracarboxylic acid128-97-264 % similar
2,3-Dihydroxybenzoic acid303-38-863 % similar
3,4-Difluoro-2-hydroxybenzoic acid189283-51-062 % similar
1-Hydroxy-2-naphthoic acid86-48-662 % similar
3-Chlorosalicylic acid1829-32-961 % similar
3-Fluoro-2-hydroxybenzoic acid341-27-559 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.