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207298-40-6 | Ethanone, 1-[4-[3-(acetyloxy)propoxy]-3-methoxyphenyl]-
CAS No: 207298-40-6 Catalog No: AG002IYE MDL No:
Product Description
Catalog Number:
AG002IYE
Chemical Name:
Ethanone, 1-[4-[3-(acetyloxy)propoxy]-3-methoxyphenyl]-
CAS Number:
207298-40-6
Molecular Formula:
C14H18O5
Molecular Weight:
266.2897
IUPAC Name:
3-(4-acetyl-2-methoxyphenoxy)propyl acetate
InChI:
InChI=1S/C14H18O5/c1-10(15)12-5-6-13(14(9-12)17-3)19-8-4-7-18-11(2)16/h5-6,9H,4,7-8H2,1-3H3
InChI Key:
KUMZHKQVOAASGI-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OCCCOC(=O)C)C(=O)C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.115g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.293g/mol
Monoisotopic Mass:
266.115g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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