Home Nitro Compounds 100867-08-1
100867-08-1,MFCD00433950
Catalog No.:AA0002Z0
100867-08-1 | Benzene, 1-methoxy-4-[(4-nitrophenyl)methoxy]-
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250mg
95.0%
3 weeks  
$143.00   $100.00
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500mg
95.0%
3 weeks  
$198.00   $139.00
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1g
95.0%
3 weeks  
$266.00   $187.00
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Technical Information
Catalog Number:
AA0002Z0
Chemical Name:
Benzene, 1-methoxy-4-[(4-nitrophenyl)methoxy]-
CAS Number:
100867-08-1
Molecular Formula:
C14H13NO4
Molecular Weight:
259.2573
MDL Number:
MFCD00433950
IUPAC Name:
1-[(4-methoxyphenoxy)methyl]-4-nitrobenzene
InChI:
InChI=1S/C14H13NO4/c1-18-13-6-8-14(9-7-13)19-10-11-2-4-12(5-3-11)15(16)17/h2-9H,10H2,1H3
InChI Key:
XGVAEAVGTOZSNS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.084g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.261g/mol
Monoisotopic Mass:
259.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Synonyms
 
1-methoxy-4-[(4-nitrobenzyl)oxy]benzene 
100867-08-1 
ZINC343848 
4-Methoxyphenyl 4-nitrobenzyl ether 
STK388844 
AKOS000121399 
MCULE-4443911317 
NE11474 
ST45107087 
1-[(4-methoxyphenoxy)methyl]-4-nitrobenzene 
4-methoxy-1-[(4-nitrophenyl)methoxy]benzene 
EN300-15520 
1-methoxy-4-[(4-nitrophenyl)methoxy]benzene 
SR-01000280388 
SR-01000280388-1 
CID824911 
ZINC00343848 
Benzene, 1-methoxy-4-[(4-nitrophenyl)methoxy]- 
AC1LGOJA 
ACMC-20esj4 
AC1Q4DQ1 
Oprea1_333991 
CTK0G8593 
DTXSID40356492 
Literature
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