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150015-67-1 | 2-Nonenoic acid, 9-[(tetrahydro-2H-pyran-2-yl)oxy]-, ethyl ester, (2E)-
CAS No: 150015-67-1 Catalog No: AG001M8B MDL No:
Product Description
Catalog Number:
AG001M8B
Chemical Name:
2-Nonenoic acid, 9-[(tetrahydro-2H-pyran-2-yl)oxy]-, ethyl ester, (2E)-
CAS Number:
150015-67-1
Molecular Formula:
C16H28O4
Molecular Weight:
284.3911
IUPAC Name:
ethyl 9-(oxan-2-yloxy)non-2-enoate
InChI:
InChI=1S/C16H28O4/c1-2-18-15(17)11-7-5-3-4-6-9-13-19-16-12-8-10-14-20-16/h7,11,16H,2-6,8-10,12-14H2,1H3
InChI Key:
AXXTXZDFSADIJE-UHFFFAOYSA-N
SMILES:
CCOC(=O)/C=C/CCCCCCOC1CCCCO1
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.199g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.396g/mol
Monoisotopic Mass:
284.199g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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