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English
Hydroxymethyl-benzenesulfonic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₇H₈O₄S
0 references
canonical SMILES
Cc1ccccc1OS(=O)(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C7H8O4S/c1-6-4-2-3-5-7(6)11-12(8,9)10/h2-5H,1H3,(H,8,9,10)
0 references
InChIKey
CYGSXDXRHXMAOV-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
26590-31-8
0 references
PubChem CID
11615528
1 reference
matched by identifier from
InChIKey
InChIKey
CYGSXDXRHXMAOV-UHFFFAOYSA-N
ChEBI ID
133089
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H8O4S/c1-6-4-2-3-5-7(6)11-12(8,9)10/h2-5H,1H3,(H,8,9,10)
EC number
247-831-7
0 references
ECHA Substance Infocard ID
100.043.468
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.043.468
retrieved
29 December 2019
title
Cresolsulphonic acid
(English)
quotation
CAS no.: 26590-31-8
(English)
AICS Chemical ID (BEING DELETED)
16662
0 references
Human Metabolome Database ID
HMDB0240655
1 reference
matched by identifier from
InChIKey
InChIKey
CYGSXDXRHXMAOV-UHFFFAOYSA-N
UNII
3X87HHK9AG
1 reference
matched by identifier from
InChIKey
InChIKey
CYGSXDXRHXMAOV-UHFFFAOYSA-N
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