CAS
62625-28-9 Purity
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62625-28-9 Purity
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Phenol,4,4'-(2,2-dioxido-3H-1,2-benzoxathiol-3-ylidene)bis[3-methyl-,sodium salt(1:1)
CAS
62625-31-4
Catalog Number
ACM62625314
Category
Other Products
Molecular Weight
404.4114
Molecular Formula
C21H18O5S.Na
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Specification
Synonyms
ZINC04261870, 62625-31-4
IUPAC Name
2-[(Z)-(4-hydroxy-2-methylphenyl)-(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
Canonical SMILES
CC1=CC(=O)C=CC1=C(C2=C(C=C(C=C2)O)C)C3=CC=CC=C3S(=O)(=O)[O-].[Na+]
InChI Key
APQRURLENAYZRH-UZYVYHOESA-M
Boiling Point
577.5ºC at 760mmHg
Appearance
orange-brown to black powder
EC Number
263-656-9
Exact Mass
404.06900
H-Bond Acceptor
5
H-Bond Donor
1
Safety Description
S22-S24/25
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