Dinicotinic acid
Properties
- Molecular formula
- C7H5NO4
- Molar mass
- 167.12 g/mol
- Exact mass
- 167.0219 Da
- Melting point
- 324 °C
- logP
- 0.48Crippen estimate
- Polar surface area
- 87.5 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98% of notifiers
Aggregated from 50 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
499-81-0SMILES
O=C(O)c1cncc(C(=O)O)c1InChIKey
MPFLRYZEEAQMLQ-UHFFFAOYSA-NInChI
InChI=1S/C7H5NO4/c9-6(10)4-1-5(7(11)12)3-8-2-4/h1-3H,(H,9,10)(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 3,5-Pyridinedicarboxylic acid
- 5-Carboxynicotinic acid
- 3,5-Pyridinedicarboxylate
- NSC 6497
Work with Dinicotinic acid
Similar compounds
5-Bromonicotinic acid20826-04-473 % similar
5-Hydroxynicotinic acid27828-71-373 % similar
5-Chloronicotinic acid22620-27-570 % similar
5-Aminonicotinic acid24242-19-170 % similar
5-Methylnicotinic acid3222-49-970 % similar
5-Fluoronicotinic acid402-66-470 % similar
5-Pyrimidinecarboxylic acid4595-61-370 % similar
Trimesic acid554-95-067 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.