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Home > Aldehydes > 1073145-56-8
1073145-56-8 | Benzaldehyde, 4-(1,1-diMethylethyl)-2-ethoxy-
CAS No: 1073145-56-8 Catalog No: AG008TDV MDL No:
Product Description
Catalog Number:
AG008TDV
Chemical Name:
Benzaldehyde, 4-(1,1-diMethylethyl)-2-ethoxy-
CAS Number:
1073145-56-8
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
IUPAC Name:
4-tert-butyl-2-ethoxybenzaldehyde
InChI:
InChI=1S/C13H18O2/c1-5-15-12-8-11(13(2,3)4)7-6-10(12)9-14/h6-9H,5H2,1-4H3
InChI Key:
ZOUJQQWUGBFCTR-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1C=O)C(C)(C)C
EC Number:
600-818-3
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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