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101080-63-1,MFCD12139149
Catalog No.:AA0003LR
101080-63-1 | 2-Chloro-1-(chloromethyl)-4-methoxybenzene
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$338.00   $237.00
- +
500mg
95.0%
3 weeks  
$573.00   $401.00
- +
1g
95.0%
3 weeks  
$743.00   $520.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0003LR
Chemical Name:
2-Chloro-1-(chloromethyl)-4-methoxybenzene
CAS Number:
101080-63-1
Molecular Formula:
C8H8Cl2O
Molecular Weight:
191.0545
MDL Number:
MFCD12139149
IUPAC Name:
2-chloro-1-(chloromethyl)-4-methoxybenzene
InChI:
InChI=1S/C8H8Cl2O/c1-11-7-3-2-6(5-9)8(10)4-7/h2-4H,5H2,1H3
InChI Key:
VCCMJKRDVTXQQC-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)Cl)CCl
Properties
Computed Properties
 
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.995g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.051g/mol
Monoisotopic Mass:
189.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Synonyms
 
2-Chloro-1-(chloromethyl)-4-methoxybenzene 
101080-63-1 
2-chloro-4-methoxybenzyl chloride 
SCHEMBL4510419 
VCCMJKRDVTXQQC-UHFFFAOYSA-N 
ZINC34362830 
NE48839 
AJ-88158 
EN300-93856 
Benzene, 2-chloro-1-(chloromethyl)-4-methoxy- 
Literature
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