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1020718-00-6 | Benzene, 1-(chloromethyl)-2-fluoro-3-nitro-
CAS No: 1020718-00-6 Catalog No: AG0006HV MDL No:MFCD09955448
Product Description
Catalog Number:
AG0006HV
Chemical Name:
Benzene, 1-(chloromethyl)-2-fluoro-3-nitro-
CAS Number:
1020718-00-6
Molecular Formula:
C7H5ClFNO2
Molecular Weight:
189.5715
MDL Number:
MFCD09955448
IUPAC Name:
1-(chloromethyl)-2-fluoro-3-nitrobenzene
InChI:
InChI=1S/C7H5ClFNO2/c8-4-5-2-1-3-6(7(5)9)10(11)12/h1-3H,4H2
InChI Key:
VSKUTYKGLMWRNW-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1F)[N+](=O)[O-]
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.999g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.57g/mol
Monoisotopic Mass:
188.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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