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732306-27-3 | 5-(Chloromethyl)-1,2,3-trifluorobenzene
CAS No: 732306-27-3 Catalog No: AG003IEQ MDL No:MFCD03001154
Product Description
Catalog Number:
AG003IEQ
Chemical Name:
5-(Chloromethyl)-1,2,3-trifluorobenzene
CAS Number:
732306-27-3
Molecular Formula:
C7H4ClF3
Molecular Weight:
180.5549
MDL Number:
MFCD03001154
IUPAC Name:
5-(chloromethyl)-1,2,3-trifluorobenzene
InChI:
InChI=1S/C7H4ClF3/c8-3-4-1-5(9)7(11)6(10)2-4/h1-2H,3H2
InChI Key:
ALUFGPFDDJIQCW-UHFFFAOYSA-N
SMILES:
ClCc1cc(F)c(c(c1)F)F
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.995g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.554g/mol
Monoisotopic Mass:
179.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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