2-(3-nitropyrazol-1-yl)acetic acid
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2-(3-nitropyrazol-1-yl)acetic acid
structure -
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CAS No:
887408-81-3
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Formula:
C5H5N3O4
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Chemical Name:
2-(3-nitropyrazol-1-yl)acetic acid
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CAS No:
2-(3-nitropyrazol-1-yl)acetic acid Basic Attributes
171.11100
171.02800565
DTXSID30390082
2933199090
Safety Information
Xi
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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.
Computed Properties
Molecular Weight:171.11
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:171.02800565
Monoisotopic Mass:171.02800565
Topological Polar Surface Area:101
Heavy Atom Count:12
Complexity:201
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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