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81574-58-5 | Benzaldehyde,2,4,6-trimethoxy-3-methyl-
CAS No: 81574-58-5 Catalog No: AG008M0F MDL No:
Product Description
Catalog Number:
AG008M0F
Chemical Name:
Benzaldehyde,2,4,6-trimethoxy-3-methyl-
CAS Number:
81574-58-5
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
2,4,6-trimethoxy-3-methylbenzaldehyde
InChI:
InChI=1S/C11H14O4/c1-7-9(13-2)5-10(14-3)8(6-12)11(7)15-4/h5-6H,1-4H3
InChI Key:
NNWWFFKWMKJCAT-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1C=O)OC)C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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