Home Halogens 4-chloro-1-[(1-methoxypropan-2-yl)oxy]-2-nitrobenzene

4-chloro-1-[(1-methoxypropan-2-yl)oxy]-2-nitrobenzene

CAS No.:
1803590-30-8
Catalog Number:
AG01AFS3
Molecular Formula:
C10H12ClNO4
Molecular Weight:
245.6596
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Product Description
Catalog Number:
AG01AFS3
Chemical Name:
4-chloro-1-[(1-methoxypropan-2-yl)oxy]-2-nitrobenzene
CAS Number:
1803590-30-8
Molecular Formula:
C10H12ClNO4
Molecular Weight:
245.6596
MDL Number:
MFCD27980651
IUPAC Name:
4-chloro-1-(1-methoxypropan-2-yloxy)-2-nitrobenzene
InChI:
InChI=1S/C10H12ClNO4/c1-7(6-15-2)16-10-4-3-8(11)5-9(10)12(13)14/h3-5,7H,6H2,1-2H3
InChI Key:
VBNFAZYMYFVMFE-UHFFFAOYSA-N
SMILES:
COCC(Oc1ccc(cc1[N+](=O)[O-])Cl)C
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.045g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.659g/mol
Monoisotopic Mass:
245.045g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties