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1741-41-9 | Propane, 1,1-diethoxy-2-methyl-
CAS No: 1741-41-9 Catalog No: AG001ZGT MDL No:MFCD00059384
Product Description
Catalog Number:
AG001ZGT
Chemical Name:
Propane, 1,1-diethoxy-2-methyl-
CAS Number:
1741-41-9
Molecular Formula:
C8H18O2
Molecular Weight:
146.2273
MDL Number:
MFCD00059384
IUPAC Name:
1,1-diethoxy-2-methylpropane
InChI:
InChI=1S/C8H18O2/c1-5-9-8(7(3)4)10-6-2/h7-8H,5-6H2,1-4H3
InChI Key:
KZDFOVZPOBSHDH-UHFFFAOYSA-N
SMILES:
CCOC(C(C)C)OCC
EC Number:
217-107-5
Properties
Complexity:
65.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.131g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.23g/mol
Monoisotopic Mass:
146.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| In-depth search focused on furans, lactones, volatile phenols, and acetals as potential age markers of Madeira wines by comprehensive two-dimensional gas chromatography with time-of-flight mass spectrometry combined with solid phase microextraction. | Journal of agricultural and food chemistry 20110413 |
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