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English
2,3-Dimethylanisole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
136.088815004
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₂O
0 references
canonical SMILES
CC1=C(C(=CC=C1)OC)C
0 references
melting point
29.0
degree Celsius
1 reference
stated in
Jean-Claude Bradley Open Melting Point Dataset
Identifiers
InChI
InChI=1S/C9H12O/c1-7-5-4-6-9(10-3)8(7)2/h4-6H,1-3H3
0 references
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
0 references
CAS Registry Number
2944-49-2
1 reference
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=2944-49-2
PubChem CID
76269
0 references
SureChEMBL ID
SCHEMBL78554
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
UniChem compound ID
12773097
1 reference
stated in
UniChem
NMRShiftDB structure ID
20208345
1 reference
matched by identifier from
InChIKey
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
DSSTox substance ID
DTXSID60183646
0 references
DSSTOX compound identifier
DTXCID00106137
0 references
NSC number
137144
0 references
EC number
220-948-0
0 references
ECHA Substance Infocard ID
100.019.044
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.019.044
retrieved
29 December 2019
title
2,3-dimethylanisole
(English)
quotation
CAS no.: 2944-49-2
(English)
KNApSAcK ID
C00061309
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
UNII
1O9C26L62B
1 reference
matched by identifier from
InChIKey
InChIKey
BLMBNEVGYRXFNA-UHFFFAOYSA-N
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