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Home > Aldehydes > 206122-92-1
206122-92-1 | Benzaldehyde, 2-methyl-4-(2-propen-1-yloxy)-
CAS No: 206122-92-1 Catalog No: AG002AJA MDL No:
Product Description
Catalog Number:
AG002AJA
Chemical Name:
Benzaldehyde, 2-methyl-4-(2-propen-1-yloxy)-
CAS Number:
206122-92-1
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
IUPAC Name:
2-methyl-4-prop-2-enoxybenzaldehyde
InChI:
InChI=1S/C11H12O2/c1-3-6-13-11-5-4-10(8-12)9(2)7-11/h3-5,7-8H,1,6H2,2H3
InChI Key:
IUZGWCJJKDSYTN-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(c(c1)C)C=O
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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