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42783-78-8 | ((2,2-Diethoxyethoxy);methyl);benzene
CAS No: 42783-78-8 Catalog No: AG003BAY MDL No:MFCD00051786
Product Description
Catalog Number:
AG003BAY
Chemical Name:
((2,2-Diethoxyethoxy);methyl);benzene
CAS Number:
42783-78-8
Molecular Formula:
C13H20O3
Molecular Weight:
224.2961
MDL Number:
MFCD00051786
IUPAC Name:
2,2-diethoxyethoxymethylbenzene
InChI:
InChI=1S/C13H20O3/c1-3-15-13(16-4-2)11-14-10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3
InChI Key:
VTYTZCJKJNWMGA-UHFFFAOYSA-N
SMILES:
CCOC(OCC)COCc1ccccc1
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.141g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.3g/mol
Monoisotopic Mass:
224.141g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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