3-Isobutyl-1H-pyrazole-5-carboxylicacid
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3-Isobutyl-1H-pyrazole-5-carboxylicacid
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CAS No:
92933-49-8
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Formula:
C8H12N2O2
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Chemical Name:
3-Isobutyl-1H-pyrazole-5-carboxylicacid
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Synonyms:
AKOS BBS-00002530;IFLAB-BB F0918-4248;CHEMBRDG-BB 4402451;3-ISOBUTYL-1H-PYRAZOLE-5-CARBOXYLIC ACID;5-ISOBUTYL-2H-PYRAZOLE-3-CARBOXYLIC ACID;3-(2-METHLYPROPYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID;3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID;5-(2-methylpropyl)-1H-pyrazole-3-carboxylic acid;1H-Pyrazole-3-carboxylic acid, 5-(2-methylpropyl)-
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CAS No:
Safety Information
|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.
3-Isobutyl-1H-pyrazole-5-carboxylicacid Use and Manufacturing
An intermediate in the synthesis of Sildenafil citrate impurity (I780620).
Computed Properties
Molecular Weight:168.19
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:168.089877630
Monoisotopic Mass:168.089877630
Topological Polar Surface Area:66
Heavy Atom Count:12
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3-Isobutyl-1H-pyrazole-5-carboxylicacid
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