2-purin-9-ylacetic acid
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2-purin-9-ylacetic acid
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CAS No:
98550-24-4
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Formula:
C7H6N4O2
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Chemical Name:
2-purin-9-ylacetic acid
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Synonyms:
purin-9-yl-acetic acid;98550-24-4;2-purin-9-ylacetic acid;NSC38843;SCHEMBL1692456;NSC-38843
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CAS No:
Safety Information
|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:178.15
XLogP3:-0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:178.04907545
Monoisotopic Mass:178.04907545
Topological Polar Surface Area:80.9
Heavy Atom Count:13
Complexity:211
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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