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(Q81989921)
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English
2,3-Naphthalenedicarboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
216.042258736
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₈O₄
0 references
canonical SMILES
C1=CC=C2C=C(C(=CC2=C1)C(=O)O)C(=O)O
0 references
Identifiers
InChI
InChI=1S/C12H8O4/c13-11(14)9-5-7-3-1-2-4-8(7)6-10(9)12(15)16/h1-6H,(H,13,14)(H,15,16)
0 references
InChIKey
KHARCSTZAGNHOT-UHFFFAOYSA-N
0 references
CAS Registry Number
2169-87-1
1 reference
InChIKey
KHARCSTZAGNHOT-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=2169-87-1
PubChem CID
95073
0 references
SureChEMBL ID
SCHEMBL69178
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KHARCSTZAGNHOT-UHFFFAOYSA-N
UniChem compound ID
24195219
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID9062229
1 reference
matched by identifier from
InChIKey
InChIKey
KHARCSTZAGNHOT-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID7036535
0 references
NSC number
16063
0 references
UNII
CE3YD57YJX
1 reference
matched by identifier from
InChIKey
InChIKey
KHARCSTZAGNHOT-UHFFFAOYSA-N
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