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1889-31-2 | Benzene, 1-cyclopentyl-2-ethoxy-
CAS No: 1889-31-2 Catalog No: AG002HHQ MDL No:
Product Description
Catalog Number:
AG002HHQ
Chemical Name:
Benzene, 1-cyclopentyl-2-ethoxy-
CAS Number:
1889-31-2
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
IUPAC Name:
1-cyclopentyl-2-ethoxybenzene
InChI:
InChI=1S/C13H18O/c1-2-14-13-10-6-5-9-12(13)11-7-3-4-8-11/h5-6,9-11H,2-4,7-8H2,1H3
InChI Key:
ISLFORKRQWAZPY-UHFFFAOYSA-N
SMILES:
CCOc1ccccc1C1CCCC1
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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