3-BROMO-4-HYDROXY-5-METHOXYPHENYLACETONITRILE
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3-BROMO-4-HYDROXY-5-METHOXYPHENYLACETONITRILE
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CAS No:
81038-44-0
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Formula:
C9H8BrNO2
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Chemical Name:
3-BROMO-4-HYDROXY-5-METHOXYPHENYLACETONITRILE
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Synonyms:
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile;2-(3-bromo-4-hydroxy-5-methoxyphenyl)acetonitrile;Benzeneacetonitrile, 3-bromo-4-hydroxy-5-methoxy-;SCHEMBL6897446;CTK3E7829;DTXSID10335052;ZINC2528065;0016AF;AKOS015834617;MCULE-2747675627
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CAS No:
3-BROMO-4-HYDROXY-5-METHOXYPHENYLACETONITRILE Basic Attributes
242.072
240.97400
DTXSID10335052
2926909090
Safety Information
UN 3439
20/21/22-36/37/38
26-36/37/39
T,Xi
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:242.07
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:240.97384
Monoisotopic Mass:240.97384
Topological Polar Surface Area:53.2
Heavy Atom Count:13
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3-BROMO-4-HYDROXY-5-METHOXYPHENYLACETONITRILE
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