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1260853-47-1 | Benzene, 2-(2-bromoethyl)-1,3,5-trifluoro-
CAS No: 1260853-47-1 Catalog No: AG000RG5 MDL No:MFCD11110101
Product Description
Catalog Number:
AG000RG5
Chemical Name:
Benzene, 2-(2-bromoethyl)-1,3,5-trifluoro-
CAS Number:
1260853-47-1
Molecular Formula:
C8H6BrF3
Molecular Weight:
239.0324
MDL Number:
MFCD11110101
IUPAC Name:
2-(2-bromoethyl)-1,3,5-trifluorobenzene
InChI:
InChI=1S/C8H6BrF3/c9-2-1-6-7(11)3-5(10)4-8(6)12/h3-4H,1-2H2
InChI Key:
CXIWXQWYAVIRCN-UHFFFAOYSA-N
SMILES:
BrCCc1c(F)cc(cc1F)F
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.96g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.035g/mol
Monoisotopic Mass:
237.96g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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