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128836-61-3 | Benzene, 1-methoxy-4-(2-phenoxypropoxy)-
CAS No: 128836-61-3 Catalog No: AG000YF0 MDL No:
Product Description
Catalog Number:
AG000YF0
Chemical Name:
Benzene, 1-methoxy-4-(2-phenoxypropoxy)-
CAS Number:
128836-61-3
Molecular Formula:
C16H18O3
Molecular Weight:
258.3123
IUPAC Name:
1-methoxy-4-(2-phenoxypropoxy)benzene
InChI:
InChI=1S/C16H18O3/c1-13(19-16-6-4-3-5-7-16)12-18-15-10-8-14(17-2)9-11-15/h3-11,13H,12H2,1-2H3
InChI Key:
AFTQROJYZMNLPX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OCC(Oc1ccccc1)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.317g/mol
Monoisotopic Mass:
258.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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