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Home > Bromides > 1260813-39-5
1260813-39-5 | Benzene, 4-(2-bromoethyl)-2-fluoro-1-methyl-
CAS No: 1260813-39-5 Catalog No: AG000RDR MDL No:
Product Description
Catalog Number:
AG000RDR
Chemical Name:
Benzene, 4-(2-bromoethyl)-2-fluoro-1-methyl-
CAS Number:
1260813-39-5
Molecular Formula:
C9H10BrF
Molecular Weight:
217.0781
IUPAC Name:
4-(2-bromoethyl)-2-fluoro-1-methylbenzene
InChI:
InChI=1S/C9H10BrF/c1-7-2-3-8(4-5-10)6-9(7)11/h2-3,6H,4-5H2,1H3
InChI Key:
HPNORIPGJNVXTB-UHFFFAOYSA-N
SMILES:
BrCCc1ccc(c(c1)F)C
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.995g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.081g/mol
Monoisotopic Mass:
215.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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