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Home > Aldehydes > 104216-97-9
104216-97-9 | 2-(2,3,4-Trimethoxyphenyl)acetaldehyde
CAS No: 104216-97-9 Catalog No: AG007YE2 MDL No:
Product Description
Catalog Number:
AG007YE2
Chemical Name:
2-(2,3,4-Trimethoxyphenyl)acetaldehyde
CAS Number:
104216-97-9
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
2-(2,3,4-trimethoxyphenyl)acetaldehyde
InChI:
InChI=1S/C11H14O4/c1-13-9-5-4-8(6-7-12)10(14-2)11(9)15-3/h4-5,7H,6H2,1-3H3
InChI Key:
FQDMSPFPWVUVKY-UHFFFAOYSA-N
SMILES:
O=CCc1ccc(c(c1OC)OC)OC
Properties
Complexity:
195
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:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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