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100888-17-3 | Octane, 1-(2-butoxyethoxy)-
CAS No: 100888-17-3 Catalog No: AG000346 MDL No:
Product Description
Catalog Number:
AG000346
Chemical Name:
Octane, 1-(2-butoxyethoxy)-
CAS Number:
100888-17-3
Molecular Formula:
C14H30O2
Molecular Weight:
230.3868
IUPAC Name:
1-(2-butoxyethoxy)octane
InChI:
InChI=1S/C14H30O2/c1-3-5-7-8-9-10-12-16-14-13-15-11-6-4-2/h3-14H2,1-2H3
InChI Key:
MDWQMPAXVXBCDY-UHFFFAOYSA-N
SMILES:
CCCCCCCCOCCOCCCC
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.225g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.392g/mol
Monoisotopic Mass:
230.225g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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