Home Aldehydes 2-Isopropyl-3,4-dimethoxybenzaldehyde

2-Isopropyl-3,4-dimethoxybenzaldehyde

CAS No.:
77256-02-1
Catalog Number:
AG005D3A
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
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Product Description
Catalog Number:
AG005D3A
Chemical Name:
2-Isopropyl-3,4-dimethoxybenzaldehyde
CAS Number:
77256-02-1
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD18207069
IUPAC Name:
3,4-dimethoxy-2-propan-2-ylbenzaldehyde
InChI:
InChI=1S/C12H16O3/c1-8(2)11-9(7-13)5-6-10(14-3)12(11)15-4/h5-8H,1-4H3
InChI Key:
RXOZTBURXHTHPR-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1OC)C(C)C)C=O
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties