methyl 5-(cyanomethyl)-1H-pyrazole-4-carboxylate
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methyl 5-(cyanomethyl)-1H-pyrazole-4-carboxylate
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CAS No:
61043-18-3
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Formula:
C7H7N3O2
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Chemical Name:
methyl 5-(cyanomethyl)-1H-pyrazole-4-carboxylate
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Synonyms:
methyl 5-(cyanomethyl)-1H-pyrazole-4-carboxylate;NSC603606;DTXSID30326604;NSC-603606;3-(cyano-methyl)-2H-pyrazole-4-carboxylic acid methyl ester
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CAS No:
methyl 5-(cyanomethyl)-1H-pyrazole-4-carboxylate Basic Attributes
165.15 g/mol
165.053826475 g/mol
603606
DTXSID30326604
Computed Properties
Molecular Weight:165.15
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:165.053826475
Monoisotopic Mass:165.053826475
Topological Polar Surface Area:78.8
Heavy Atom Count:12
Complexity:220
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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