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22532-53-2 | 4-Ethoxyphenethyl acetate
CAS No: 22532-53-2 Catalog No: AG01FFIN MDL No:
Product Description
Catalog Number:
AG01FFIN
Chemical Name:
4-Ethoxyphenethyl acetate
CAS Number:
22532-53-2
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
IUPAC Name:
2-(4-ethoxyphenyl)ethyl acetate
InChI:
InChI=1S/C12H16O3/c1-3-14-12-6-4-11(5-7-12)8-9-15-10(2)13/h4-7H,3,8-9H2,1-2H3
InChI Key:
KIKKSFNBPWDLST-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)CCOC(=O)C
NSC Number:
190947
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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