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85071-59-6 | Benzaldehyde, 2,3,5-trimethoxy-4-methyl-
CAS No: 85071-59-6 Catalog No: AG004YE3 MDL No:
Product Description
Catalog Number:
AG004YE3
Chemical Name:
Benzaldehyde, 2,3,5-trimethoxy-4-methyl-
CAS Number:
85071-59-6
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
2,3,5-trimethoxy-4-methylbenzaldehyde
InChI:
InChI=1S/C11H14O4/c1-7-9(13-2)5-8(6-12)11(15-4)10(7)14-3/h5-6H,1-4H3
InChI Key:
YHMDMFQLWVQIDS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)c(c(c1OC)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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