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Home > Bromides > 1393442-56-2
1393442-56-2 | Benzene, 1-bromo-2-(dimethoxymethyl)-3-fluoro-
CAS No: 1393442-56-2 Catalog No: AG001AS3 MDL No:MFCD22383787
Product Description
Catalog Number:
AG001AS3
Chemical Name:
Benzene, 1-bromo-2-(dimethoxymethyl)-3-fluoro-
CAS Number:
1393442-56-2
Molecular Formula:
C9H10BrFO2
Molecular Weight:
249.0769
MDL Number:
MFCD22383787
IUPAC Name:
1-bromo-2-(dimethoxymethyl)-3-fluorobenzene
InChI:
InChI=1S/C9H10BrFO2/c1-12-9(13-2)8-6(10)4-3-5-7(8)11/h3-5,9H,1-2H3
InChI Key:
PKIZATGPJNVPSE-UHFFFAOYSA-N
SMILES:
COC(c1c(F)cccc1Br)OC
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.079g/mol
Monoisotopic Mass:
247.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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