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Home > Aldehydes > 105337-42-6
105337-42-6 | 5-Isopropyl-4-methoxy-2-methylbenzaldehyde
CAS No: 105337-42-6 Catalog No: AG003MTL MDL No:MFCD02629380
Product Description
Catalog Number:
AG003MTL
Chemical Name:
5-Isopropyl-4-methoxy-2-methylbenzaldehyde
CAS Number:
105337-42-6
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD02629380
IUPAC Name:
4-methoxy-2-methyl-5-propan-2-ylbenzaldehyde
InChI:
InChI=1S/C12H16O2/c1-8(2)11-6-10(7-13)9(3)5-12(11)14-4/h5-8H,1-4H3
InChI Key:
UREBGRBNUQCTAF-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(cc1C(C)C)C=O
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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