5-Nitrosalicylaldehyde
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5-Nitrosalicylaldehyde
structure -
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CAS No:
97-51-8
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Formula:
C7H5NO4
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Chemical Name:
5-Nitrosalicylaldehyde
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Synonyms:
Benzaldehyde,2-hydroxy-5-nitro-;Salicylaldehyde,5-nitro-;2-Hydroxy-5-nitrobenzaldehyde;5-Nitro-2-hydroxybenzaldehyde;5-Nitrosalicylaldehyde;6-Hydroxy-3-nitrobenzaldehyde;2-Formyl-4-nitrophenol;NSC 881;NSC 97387;5-Nitrosalicylaladhyde;2-Hydroxy-5-nitrobenzaldehye;1186389-55-8;1391922-17-0
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CAS No:
Characteristics
83.12000
2
Slight yellow powder
1.5g/cm3
126 °C @ Solvent: Acetic acid
300.2ºC at 760mmHg
137.3ºC
1.667
Soluble in water (partly).
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Safety Information
NONH for all modes of transport
3
R22; R36/37/38
S26-S37/39
CU6675000
Xn
Stable at room temperature in closed containers under normal storage and handling conditions.
P305 + P351 + P338
H302-H315-H319
|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|Aggregated GHS information provided by 51 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-Nitrosalicylaldehyde Use and Manufacturing
5-Nitrosalicylaldehyde is used in the synthetic preparation of coumarin (C755380), an pharmaceutic aid that is found in tonka beans, lavender oil, woodruff, sweet clover.
Benzaldehyde, 2-hydroxy-5-nitro-: ACTIVE
Computed Properties
Molecular Weight:167.12
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:167.02185764
Monoisotopic Mass:167.02185764
Topological Polar Surface Area:83.1
Heavy Atom Count:12
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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