Home Other Building Blocks 1004-66-6
1004-66-6,MFCD00008380
Catalog No.:AA0001TY
1004-66-6 | 2,6-Dimethylanisole
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Purity
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Price(USD)
Quantity
  
5g
97%
in stock  
$14.00   $10.00
- +
25g
97%
in stock  
$43.00   $30.00
- +
100g
97%
in stock  
$129.00   $90.00
- +
500g
97%
in stock  
$603.00   $422.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0001TY
Chemical Name:
2,6-Dimethylanisole
CAS Number:
1004-66-6
Molecular Formula:
C9H12O
Molecular Weight:
136.1910
MDL Number:
MFCD00008380
IUPAC Name:
2-methoxy-1,3-dimethylbenzene
InChI:
InChI=1S/C9H12O/c1-7-5-4-6-8(2)9(7)10-3/h4-6H,1-3H3
InChI Key:
GFNZJAUVJCGWLW-UHFFFAOYSA-N
SMILES:
COc1c(C)cccc1C
EC Number:
213-723-3
NSC Number:
62672
Properties
Computed Properties
 
Complexity:
90.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.089g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.194g/mol
Monoisotopic Mass:
136.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
2,6-Dimethylanisole 
1004-66-6 
PubChem4115 
2,6-dimethyl anisole 
ACMC-1BUUC 
AI3-21152 
AC1Q2QYN 
AC1L24LK 
2,6-Dimethylanisole, 98% 
KSC493Q8R 
SCHEMBL145464 
2,6-dimethylphenyl methyl ether 
2-Methoxy-1,3-dimethylbenzene 
2-methoxy-1,3-dimethyl-benzene 
CTK3J3888 
KS-00000YOE 
DTXSID40143248 
2-Methoxy-1,3-dimethylbenzene # 
ACT11789 
ZINC1691296 
ANW-14290 
NSC-62672 
AKOS015891256 
2-Methoxy-m-xylene 
AS02543 
AS04213 
RP20285 
AJ-30107 
AN-48266 
CJ-06495 
CJ-28184 
SY048974 
AB0009766 
RT-001751 
Benzene, 2-methoxy-1,3-dimethyl- 
ST2417001 
D2383 
FT-0610697 
MFCD00008380 (97%) 
A19922 
M-3382 
I01-8772 
W-109629 
2-Methoxy-m-xylene;2-Methoxy-1,3-dimethylbenzene;2-Methoxy-1,3-dimethyl-benzene 
C9H12O 
1,3-Dimethyl-2-methoxybenzene 
C9-H12-O 
CID66088 
GFNZJAUVJCGWLW-UHFFFAOYSA-N 
MFCD00008380 
NSC62672 
EINECS 213-723-3 
Literature

Title: Molecular Insights into the Local Anesthetic Receptor within Voltage-Gated Sodium Channels Using Hydroxylated Analogs of Mexiletine.

Journal: Frontiers in pharmacology 20120101

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