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831170-89-9 | Benzene, 1-[(1-ethyl-2-propenyl)oxy]-3,5-dimethoxy-
CAS No: 831170-89-9 Catalog No: AG005BBI MDL No:
Product Description
Catalog Number:
AG005BBI
Chemical Name:
Benzene, 1-[(1-ethyl-2-propenyl)oxy]-3,5-dimethoxy-
CAS Number:
831170-89-9
Molecular Formula:
C13H18O3
Molecular Weight:
222.2802
IUPAC Name:
1,3-dimethoxy-5-pent-1-en-3-yloxybenzene
InChI:
InChI=1S/C13H18O3/c1-5-10(6-2)16-13-8-11(14-3)7-12(9-13)15-4/h5,7-10H,1,6H2,2-4H3
InChI Key:
LKOUXYWHMJYAED-UHFFFAOYSA-N
SMILES:
CCC(Oc1cc(OC)cc(c1)OC)C=C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.284g/mol
Monoisotopic Mass:
222.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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