Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1)
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Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1)
structure -
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CAS No:
62625-30-3
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Formula:
C21H16Br2O5S.Na
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Chemical Name:
Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1)
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Synonyms:
Phenol,4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-,sodium salt (1:1);Phenol,4,4′-(3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-,S,S-dioxide,monosodium salt;Phenol,4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-,monosodium salt;3H-2,1-Benzoxathiole,phenol deriv.;Bromocresol purple sodium;1159834-11-3
- Categories:
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CAS No:
Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1) Basic Attributes
562.2
559.890442
263-655-3
29147000
Characteristics
102.88000
6.05770
Red-brown Powder
0.991 g/mL at 25 °C
255 °C (dec.)(lit.)
590.2ºC at 760mmHg
H2O: soluble
Store at RT.
Safety Information
NONH for all modes of transport
3
36/37/38
26-36/37-24/25-36
Xi
P261-P305 + P351 + P338
H315-H319-H335
|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|Aggregated GHS information provided by 54 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1) Use and Manufacturing
Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1): ACTIVE
Computed Properties
Molecular Weight:562.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:561.88841
Monoisotopic Mass:559.89046
Topological Polar Surface Area:103
Heavy Atom Count:30
Complexity:874
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Phenol, 4,4′-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, sodium salt (1:1)
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