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846031-57-0 | Benzene,2-chloro-1-ethoxy-3-nitro-
CAS No: 846031-57-0 Catalog No: AG00511O MDL No:MFCD11113247
Product Description
Catalog Number:
AG00511O
Chemical Name:
Benzene,2-chloro-1-ethoxy-3-nitro-
CAS Number:
846031-57-0
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
MDL Number:
MFCD11113247
IUPAC Name:
2-chloro-1-ethoxy-3-nitrobenzene
InChI:
InChI=1S/C8H8ClNO3/c1-2-13-7-5-3-4-6(8(7)9)10(11)12/h3-5H,2H2,1H3
InChI Key:
RDZFDWBNJDFXFN-UHFFFAOYSA-N
SMILES:
CCOc1cccc(c1Cl)[N+](=O)[O-]
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.019g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.606g/mol
Monoisotopic Mass:
201.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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