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100948-83-2,MFCD00983851
Catalog No.:AA000378
100948-83-2 | 1,3-Dichloro-5-methoxy-2-nitrobenzene
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Purity
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Price(USD)
Quantity
  
250mg
95%
in stock  
$129.00   $90.00
- +
1g
95%
in stock  
$283.00   $198.00
- +
5g
95%
in stock  
$943.00   $660.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA000378
Chemical Name:
1,3-Dichloro-5-methoxy-2-nitrobenzene
CAS Number:
100948-83-2
Molecular Formula:
C7H5Cl2NO3
Molecular Weight:
222.0255
MDL Number:
MFCD00983851
IUPAC Name:
1,3-dichloro-5-methoxy-2-nitrobenzene
InChI:
InChI=1S/C7H5Cl2NO3/c1-13-4-2-5(8)7(10(11)12)6(9)3-4/h2-3H,1H3
InChI Key:
ZXJNASYUWVEBAH-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(c(c1)Cl)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.965g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.021g/mol
Monoisotopic Mass:
220.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
1,3-dichloro-5-methoxy-2-nitrobenzene 
100948-83-2 
MFCD00983851 
AKOS005174361 
AS04441 
FCH1601797 
LS10046 
1,3-Dichloro-2-nitrobenzene-5-methoxy 
AJ-26486 
AK126071 
AS-33034 
AX8176178 
1,3-Dichloro-5-methoxy-2-nitro-benzene 
Benzene, 1,3-dichloro-5-methoxy-2-nitro- 
ST24036794 
Z-5342 
C7H5Cl2NO3 
ZINC01512456 
CID4312075 
17742-69-7 
3,5-Dichloro-4-nitroanisole;1,3-Dichloro-2-methoxy-5-nitrobenzene 
PubChem22693 
AC1N82JA 
SCHEMBL11126330 
DTXSID70401828 
ZINC1512456 
9616AH 
Literature
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