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206280-76-4 | Octane, 1-bromo-8-(2-ethoxyethoxy)-
CAS No: 206280-76-4 Catalog No: AG002IF2 MDL No:
Product Description
Catalog Number:
AG002IF2
Chemical Name:
Octane, 1-bromo-8-(2-ethoxyethoxy)-
CAS Number:
206280-76-4
Molecular Formula:
C12H25BrO2
Molecular Weight:
281.2297
IUPAC Name:
1-bromo-8-(2-ethoxyethoxy)octane
InChI:
InChI=1S/C12H25BrO2/c1-2-14-11-12-15-10-8-6-4-3-5-7-9-13/h2-12H2,1H3
InChI Key:
DBKXJLKZEFCRNP-UHFFFAOYSA-N
SMILES:
BrCCCCCCCCOCCOCC
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.104g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.234g/mol
Monoisotopic Mass:
280.104g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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