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(Q107842458)
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2-methoxy-3,5-dimethylbenzoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
180.078644244
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₂O₃
1 reference
PubChem CID
18954608
retrieved
12 June 2021
canonical SMILES
CC1=CC(=C(C(=C1)C(=O)O)OC)C
1 reference
PubChem CID
18954608
retrieved
12 June 2021
melting point
97.5±0.5
degree Celsius
1 reference
stated in
Melting Point and Pyrolysis Point Data for Tens of Thousands of Chemicals
Identifiers
InChI
InChI=1S/C10H12O3/c1-6-4-7(2)9(13-3)8(5-6)10(11)12/h4-5H,1-3H3,(H,11,12)
1 reference
PubChem CID
18954608
retrieved
12 June 2021
InChIKey
WEUQEKDZMFUQFT-UHFFFAOYSA-N
1 reference
PubChem CID
18954608
retrieved
12 June 2021
CAS Registry Number
21553-47-9
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
18954608
2 references
retrieved
12 June 2021
matched by identifier from
InChIKey
InChIKey
WEUQEKDZMFUQFT-UHFFFAOYSA-N
UniChem compound ID
25499052
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101297958
1 reference
matched by identifier from
InChIKey
InChIKey
WEUQEKDZMFUQFT-UHFFFAOYSA-N
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