3-Isoquinolinecarboxylic acid hydrate (1:1)

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Names

[ CAS No. ]:
207399-25-5

[ Name ]:
3-Isoquinolinecarboxylic acid hydrate (1:1)

[Synonym ]:
3-Isoquinolinecarboxylic acid hydrate (1:1)
3-Isoquinolinecarboxylic acid, hydrate (1:1)
3-Isoquinolinecarboxylic Acid Hydrate
Isoquinoline-3-carboxylic acid hydrate (1:1)
ISOQUINOLINE-3-CARBOXYLIC ACID HYDRATE
3-isoquinolinecarboxylate
MFCD00167216

Chemical & Physical Properties

[ Boiling Point ]:
366.4ºC at 760 mmHg

[ Melting Point ]:
166-168 °C(lit.)

[ Molecular Formula ]:
C10H9NO3

[ Molecular Weight ]:
191.183

[ Exact Mass ]:
191.058243

[ PSA ]:
59.42000

[ LogP ]:
1.86870

[ Vapour Pressure ]:
5.15E-06mmHg at 25°C

MSDS

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Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39-S37

[ WGK Germany ]:
3

Related Compounds

  • 6-Hydroxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrate (1:1)
  • 3-Aminoisonicotinic acid hydrate (1:1)
  • 3-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-, 1,1-DIMETHYLETHYL ESTER, HYDROCHLORIDE, (S)-
  • 3-Isoquinolinecarboxylic acid, 6,7-dihydroxy- (9CI)
  • 3-Isoquinolinecarboxylic acid, 7,8-dihydroxy- (9CI)
  • (3R)-2-(4-Methoxybenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid