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62618-37-5 | Benzeneacetaldehyde, 3,4-diethoxy-
CAS No: 62618-37-5 Catalog No: AG01FE9Q MDL No:
Product Description
Catalog Number:
AG01FE9Q
Chemical Name:
Benzeneacetaldehyde, 3,4-diethoxy-
CAS Number:
62618-37-5
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
IUPAC Name:
2-(3,4-diethoxyphenyl)acetaldehyde
InChI:
InChI=1S/C12H16O3/c1-3-14-11-6-5-10(7-8-13)9-12(11)15-4-2/h5-6,8-9H,3-4,7H2,1-2H3
InChI Key:
DFRSGLWCOKPLEN-UHFFFAOYSA-N
SMILES:
O=CCc1ccc(c(c1)OCC)OCC
Properties
Complexity:
182
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:
1.6
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