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30989-73-2 | Heptane, 2-(diethoxymethyl)-1,1-diethoxy-
CAS No: 30989-73-2 Catalog No: AG0031UR MDL No:
Product Description
Catalog Number:
AG0031UR
Chemical Name:
Heptane, 2-(diethoxymethyl)-1,1-diethoxy-
CAS Number:
30989-73-2
Molecular Formula:
C16H34O4
Molecular Weight:
290.4388
IUPAC Name:
2-(diethoxymethyl)-1,1-diethoxyheptane
InChI:
InChI=1S/C16H34O4/c1-6-11-12-13-14(15(17-7-2)18-8-3)16(19-9-4)20-10-5/h14-16H,6-13H2,1-5H3
InChI Key:
FYVVSNOKHFMGID-UHFFFAOYSA-N
SMILES:
CCCCCC(C(OCC)OCC)C(OCC)OCC
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.246g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.444g/mol
Monoisotopic Mass:
290.246g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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