Benzoic acid, 3-(1-formyl-2-oxoethyl)-4-nitro-, hydrate (1:1)
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Benzoic acid, 3-(1-formyl-2-oxoethyl)-4-nitro-, hydrate (1:1)
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CAS No:
205680-84-8
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Formula:
C10H7NO6.H2O
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Chemical Name:
Benzoic acid, 3-(1-formyl-2-oxoethyl)-4-nitro-, hydrate (1:1)
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Synonyms:
Benzoic acid,3-(1-formyl-2-oxoethyl)-4-nitro-,hydrate (1:1);Benzoic acid,3-(1-formyl-2-oxoethyl)-4-nitro-,monohydrate
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CAS No:
Benzoic acid, 3-(1-formyl-2-oxoethyl)-4-nitro-, hydrate (1:1) Basic Attributes
255.18100
255.03790163
DTXSID70371431
2918300090
Safety Information
Xi
|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.
Computed Properties
Molecular Weight:255.18
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:255.03790163
Monoisotopic Mass:255.03790163
Topological Polar Surface Area:118
Heavy Atom Count:18
Complexity:328
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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