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5-hydroxybenzimidazole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
phenol
0 references
benzimidazole
0 references
mass
134.048012812
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₆N₂O
0 references
canonical SMILES
C1=CC2=C(C=C1O)NC=N2
0 references
Identifiers
InChI
InChI=1S/C7H6N2O/c10-5-1-2-6-7(3-5)9-4-8-6/h1-4,10H,(H,8,9)
0 references
InChIKey
KRKSOBREFNTJJY-UHFFFAOYSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
CAS Registry Number
41292-65-3
1 reference
InChIKey
KRKSOBREFNTJJY-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=41292-65-3
PubChem CID
3082533
1 reference
matched by identifier from
InChIKey
InChIKey
KRKSOBREFNTJJY-UHFFFAOYSA-N
Reaxys registry number
3254
1 reference
stated in
ChEBI release 2019-11-01
ChEBI ID
137404
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H6N2O/c10-5-1-2-6-7(3-5)9-4-8-6/h1-4,10H,(H,8,9)
SureChEMBL ID
SCHEMBL352025
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KRKSOBREFNTJJY-UHFFFAOYSA-N
UniChem compound ID
8694023
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00194276
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
KRKSOBREFNTJJY-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10116767
0 references
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