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861928-18-9 | Benzene, 1,4-dibromo-2-(dimethoxymethyl)-3-fluoro-
CAS No: 861928-18-9 Catalog No: AG004K5Y MDL No:
Product Description
Catalog Number:
AG004K5Y
Chemical Name:
Benzene, 1,4-dibromo-2-(dimethoxymethyl)-3-fluoro-
CAS Number:
861928-18-9
Molecular Formula:
C9H9Br2FO2
Molecular Weight:
327.9730
IUPAC Name:
1,4-dibromo-2-(dimethoxymethyl)-3-fluorobenzene
InChI:
InChI=1S/C9H9Br2FO2/c1-13-9(14-2)7-5(10)3-4-6(11)8(7)12/h3-4,9H,1-2H3
InChI Key:
KVMAEJHRDCUBCT-UHFFFAOYSA-N
SMILES:
COC(c1c(Br)ccc(c1F)Br)OC
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.893g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.975g/mol
Monoisotopic Mass:
325.895g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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