6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID
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6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID
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CAS No:
1197-10-0
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Formula:
C7H7NO3
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Chemical Name:
6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID
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Synonyms:
6-(Hydroxymethyl)picolinic acid;6-Hydroxymethyl-pyridine-2-carboxylic acid;6-(hydroxymethyl)pyridine-2-carboxylic Acid;2-Pyridinecarboxylic acid, 6-(hydroxymethyl)-;ic acid;L-Lysinebase;6-Hydroxymethyl-pyridine-2-carboxyl;6-hydroxymethylpicolinic acid;SCHEMBL347912;CTK0H3527
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CAS No:
6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID Basic Attributes
153.13538
153.042587
DTXSID80472746
2933399090
Safety Information
IRRITANT
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID Use and Manufacturing
6-Hydroxymethyl-pyridine-2-carboxylic acid ethylester (200 mg, 1.1 mmol) (J. Amer. Chem. Soc, 1982, 104, 2251-2257) was dissolved in methanol (1 ml). Thereafter, therein 2N NAOH aqueous solution (1 ml) was slowly added dropwise, and the reaction mixture was stirred at room temperature for 1 hour. The reaction mixture was acidified (pH=3) with 2N HC1. Solvent was concentrated under reduced pressure, then, dissolved in methanol and filtered. The filtrate was concentrated under reduced pressure to give 150 mg (yield: 89percent, white solid) of the target compound. 1H NMR (400MHZ, CD30D) : 55. 05 (s, 2H), 8.34 (d, J=8. OHZ, 1H), 8.47 (d, J=8. OHZ, 1H) 8.73 (d, J=8. OHz, 1H)
Computed Properties
Molecular Weight:153.14
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:153.042593085
Monoisotopic Mass:153.042593085
Topological Polar Surface Area:70.4
Heavy Atom Count:11
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLICACID
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