2-Hydroxyquinoline-4-carboxylic acid
PubChem CID: 85076
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 2-Hydroxyquinoline-4-carboxylic acid, 15733-89-8, 84906-81-0, 2-oxo-1,2-dihydroquinoline-4-carboxylic acid, 2-Hydroxycinchoninic acid, 2-Hydroxy-4-quinolincarboxylic acid, 4-Carboxycarbostyril, 2-oxo-1H-quinoline-4-carboxylic acid, Cinchoninic acid, 2-hydroxy-, 4-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, 2-oxocinchoninic acid, Cinchocaine Impurity B, 1,2-Dihydro-2-oxoquinoline-4-carboxylic acid, 2-hydroxy-4-quinolinecarboxylic acid, MFCD00023942, 2-Hydroxy-quinoline-4-carboxylic acid, 4-Quinolinecarboxylic acid, 2-hydroxy-, Z1Q2K479UQ, CHEBI:52045, 1,2-dihydro-2-oxo-4-Quinolinecarboxylic acid, NSC-3564, 2-Oxo-1,2-dihydro-4-quinolinecarboxylic acid, EINECS 239-827-9, 1,?2-?Dihydro-?2-?oxo-4-?quinolinecarboxylic Acid, UNII-Z1Q2K479UQ, AI3-61768, 2-oxo-4-quinolinecarboxylic acid, Cinchocaine Hydrochloride Imp. B (EP), Cinchocaine Imp. B (EP), 2-Hydroxyquinoline-4-carboxylic Acid, Cinchocaine Hydrochloride Impurity B, Cinchocaine Impurity B, MFCD00464512, Enamine_001230, Cambridge id 5133898, Oprea1_034107, SCHEMBL662652, IFLab1_001493, SCHEMBL8729784, CHEMBL2048387, MFSHNFBQNVGXJX-UHFFFAOYSA-, DTXSID40166250, NSC3564, HMS1397H20, HMS1416D19, ALBB-010502, BCP28536, CCG-1662, NSC 3564, BBL008901, STK078430, STK709494, 2-Hydroxyquinolinecarboxylic acid-(4), AKOS000104068, AKOS000266346, 2(1H)-Oxoquinoline-4-carboxylic acid, AC-1861, CCG-104483, CS-W015953, FH44004, SB67443, SDCCGMLS-0065426.P001, NCGC00246893-01, AC-23085, AS-12503, SY020050, Quinoline-4-carboxylic acid, 2(1H)-oxo-, 2-Hydroxyquinoline-4-carboxylic acid, 97%, DB-012013, EU-0001998, H1016, NS00025117, EN300-00825, D78174, 2-Oxo-1,2-dihydro-4-quinolinecarboxylic acid #, AE-641/00397053, SR-01000403999, SR-01000597059, SR-01000403999-1, SR-01000597059-1, SR-01000597059-2, Q27123129, Z56795730, F0346-1608, 2-Oxo-1,2-dihydroquinoline-4-carboxylic acid, AldrichCPR, CINCHOCAINE HYDROCHLORIDE IMPURITY B [EP IMPURITY], Cinchocaine Hydrochloride Imp. B (EP): 2-Hydroxyquinoline-4-, InChI=1/C10H7NO3/c12-9-5-7(10(13)14)6-3-1-2-4-8(6)11-9/h1-5H,(H,11,12)(H,13,14) |
|---|---|
| Topological Polar Surface Area | 66.4 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 14.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 308.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | O15294 |
| Iupac Name | 2-oxo-1H-quinoline-4-carboxylic acid |
| Prediction Hob | 1.0 |
| Xlogp | 0.6 |
| Molecular Formula | C10H7NO3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MFSHNFBQNVGXJX-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -3.017 |
| Rotatable Bond Count | 1.0 |
| Logd | 0.982 |
| Compound Name | 2-Hydroxyquinoline-4-carboxylic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 189.043 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 189.043 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 189.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.9244254285714284 |
| Inchi | InChI=1S/C10H7NO3/c12-9-5-7(10(13)14)6-3-1-2-4-8(6)11-9/h1-5H,(H,11,12)(H,13,14) |
| Smiles | C1=CC=C2C(=C1)C(=CC(=O)N2)C(=O)O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aloe Microstigma (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Chrozophora Prostrata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Papaver Somniferum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Rubus Chingii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Rubus Coreanus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Rubus Idaeus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all