Home Halogens 2-(chloromethyl)-4-fluoro-1-nitrobenzene

2-(chloromethyl)-4-fluoro-1-nitrobenzene

CAS No.:
109115-05-1
Catalog Number:
AG01BZJF
Molecular Formula:
C7H5ClFNO2
Molecular Weight:
189.5715
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Product Description
Catalog Number:
AG01BZJF
Chemical Name:
2-(chloromethyl)-4-fluoro-1-nitrobenzene
CAS Number:
109115-05-1
Molecular Formula:
C7H5ClFNO2
Molecular Weight:
189.5715
MDL Number:
MFCD13185628
IUPAC Name:
2-(chloromethyl)-4-fluoro-1-nitrobenzene
InChI:
InChI=1S/C7H5ClFNO2/c8-4-5-3-6(9)1-2-7(5)10(11)12/h1-3H,4H2
InChI Key:
RRDMOQVRYCINEH-UHFFFAOYSA-N
SMILES:
ClCc1cc(F)ccc1[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  
Properties