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157143-20-9 | Benzaldehyde, 3-ethoxy-4-methyl-
CAS No: 157143-20-9 Catalog No: AG001P8L MDL No:
Product Description
Catalog Number:
AG001P8L
Chemical Name:
Benzaldehyde, 3-ethoxy-4-methyl-
CAS Number:
157143-20-9
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
IUPAC Name:
3-ethoxy-4-methylbenzaldehyde
InChI:
InChI=1S/C10H12O2/c1-3-12-10-6-9(7-11)5-4-8(10)2/h4-7H,3H2,1-2H3
InChI Key:
IFELWTOFCUUHBY-UHFFFAOYSA-N
SMILES:
CCOc1cc(C=O)ccc1C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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