3,4-Dihydroxybenzonitrile
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3,4-Dihydroxybenzonitrile
structure -
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CAS No:
17345-61-8
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Formula:
C7H5NO2
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Chemical Name:
3,4-Dihydroxybenzonitrile
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Synonyms:
Benzonitrile,3,4-dihydroxy-;Protocatechunitrile;3,4-Dihydroxybenzonitrile;4-Cyanopyrocatechol;4-Cyano-1,2-dihydroxybenzene;4-Cyanobenzene-1,2-diol;4-Cyanocatechol
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CAS No:
Characteristics
64.25000
0.96948
white or white like crystalline powder
1.42g/cm3
154-156ºC
334.8ºC
156.3ºC
1.647
insoluble
6.43E-05mmHg at 25°C
Safety Information
III
6.1
UN3439
3
R20/21/22; R36/37/38
S22-S26-S36/37/39
Xn
|Warning|H302 (95.65%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 46 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:135.12
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:135.032028402
Monoisotopic Mass:135.032028402
Topological Polar Surface Area:64.2
Heavy Atom Count:10
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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