2-(6-nitro-1,3-benzodioxol-5-yl)acetic acid
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2-(6-nitro-1,3-benzodioxol-5-yl)acetic acid
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CAS No:
40118-17-0
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Formula:
C9H7NO6
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Chemical Name:
2-(6-nitro-1,3-benzodioxol-5-yl)acetic acid
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Synonyms:
(6-nitro-1,3-benzodioxol-5-yl)acetic acid;40118-17-0;2-(6-nitro-1,3-benzodioxol-5-yl)acetic acid;NSC102269;1,3-Benzodioxole-5-aceticacid, 6-nitro-;NCIOpen2_007026;SCHEMBL121810;DTXSID20295476;ZINC1674639;NSC-102269;DS-008301
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CAS No:
2-(6-nitro-1,3-benzodioxol-5-yl)acetic acid Basic Attributes
225.15 g/mol
225.02733694 g/mol
102269
DTXSID20295476
Computed Properties
Molecular Weight:225.15
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:225.02733694
Monoisotopic Mass:225.02733694
Topological Polar Surface Area:102
Heavy Atom Count:16
Complexity:301
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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