1,3,5-Benzenetriol, hydrate (1:2)
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1,3,5-Benzenetriol, hydrate (1:2)
structure -
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CAS No:
6099-90-7
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Formula:
C6H6O3.2H2O
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Chemical Name:
1,3,5-Benzenetriol, hydrate (1:2)
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Synonyms:
1,3,5-Benzenetriol,hydrate (1:2);Phloroglucinol,dihydrate;1,3,5-Benzenetriol,dihydrate
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CAS No:
1,3,5-Benzenetriol, hydrate (1:2) Basic Attributes
162.14100
162.05300
0X7B22BRG1
DTXSID3046586
2907299090
Characteristics
79.15000
0.67480
off-white powder
215-217 °C (decomp) @ Solvent: Water
331.1°C at 760 mmHg
100 °C
H2O: slightly soluble
Store at RT.
Safety Information
NONH for all modes of transport
2
R36/37/38
S37/39; S26; S36
DC4662500
Xi
Stable. Incompatible with acid chlorides, acid anhydrides, bases, oxidizing agents. Combustible.
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1,3,5-Benzenetriol, hydrate (1:2) Use and Manufacturing
Used as analytical reagents, used in pharmaceuticals, biological reagents, dyes, and for the synthesis of 57-dihydroxyflavone
Computed Properties
Molecular Weight:162.14
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:5
Exact Mass:162.05282342
Monoisotopic Mass:162.05282342
Topological Polar Surface Area:62.7
Heavy Atom Count:11
Complexity:63.3
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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