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101447-69-2 | Benzene, 1,4-dimethoxy-2-octyl-
CAS No: 101447-69-2 Catalog No: AG0004I7 MDL No:
Product Description
Catalog Number:
AG0004I7
Chemical Name:
Benzene, 1,4-dimethoxy-2-octyl-
CAS Number:
101447-69-2
Molecular Formula:
C16H26O2
Molecular Weight:
250.3764
IUPAC Name:
1,4-dimethoxy-2-octylbenzene
InChI:
InChI=1S/C16H26O2/c1-4-5-6-7-8-9-10-14-13-15(17-2)11-12-16(14)18-3/h11-13H,4-10H2,1-3H3
InChI Key:
YWCFPDHDTXQKNY-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1cc(OC)ccc1OC
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.193g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.382g/mol
Monoisotopic Mass:
250.193g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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