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128912-39-0 | Furan, 2,5-dihexyl-
CAS No: 128912-39-0 Catalog No: AG000YIV MDL No:
Product Description
Catalog Number:
AG000YIV
Chemical Name:
Furan, 2,5-dihexyl-
CAS Number:
128912-39-0
Molecular Formula:
C16H28O
Molecular Weight:
236.3929
IUPAC Name:
2,5-dihexylfuran
InChI:
InChI=1S/C16H28O/c1-3-5-7-9-11-15-13-14-16(17-15)12-10-8-6-4-2/h13-14H,3-12H2,1-2H3
InChI Key:
RHHVLNBHUWBEIG-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(o1)CCCCCC
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.214g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.399g/mol
Monoisotopic Mass:
236.214g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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