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1141669-81-9 | Benzenemethanol, 2,4-diethoxy-α-methyl-
CAS No: 1141669-81-9 Catalog No: AG000APK MDL No:MFCD12198840
Product Description
Catalog Number:
AG000APK
Chemical Name:
Benzenemethanol, 2,4-diethoxy-α-methyl-
CAS Number:
1141669-81-9
Molecular Formula:
C12H18O3
Molecular Weight:
210.2695
MDL Number:
MFCD12198840
IUPAC Name:
1-(2,4-diethoxyphenyl)ethanol
InChI:
InChI=1S/C12H18O3/c1-4-14-10-6-7-11(9(3)13)12(8-10)15-5-2/h6-9,13H,4-5H2,1-3H3
InChI Key:
HLEWKJICLMIORG-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)OCC)C(O)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.273g/mol
Monoisotopic Mass:
210.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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