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3-Methylveratrole
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
152.083729624
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₂O₂
0 references
canonical SMILES
CC1=C(C(=CC=C1)OC)OC
0 references
Identifiers
InChI
InChI=1S/C9H12O2/c1-7-5-4-6-8(10-2)9(7)11-3/h4-6H,1-3H3
0 references
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
0 references
CAS Registry Number
4463-33-6
1 reference
stated in
CAS Common Chemistry
retrieved
7 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=4463-33-6
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
PubChem CID
78215
1 reference
matched by identifier from
InChIKey
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL134856
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
UniChem compound ID
18219138
1 reference
stated in
UniChem
NMRShiftDB structure ID
20032745
1 reference
matched by identifier from
InChIKey
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
DSSTox substance ID
DTXSID40196259
1 reference
matched by identifier from
InChIKey
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00118750
0 references
NSC number
72350
0 references
UNII
5PN3R2H4NL
1 reference
matched by identifier from
InChIKey
InChIKey
WMXFNCKPYCAIQW-UHFFFAOYSA-N
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