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Home > Aldehydes > 109523-70-8
109523-70-8 | 1H-Indole-3-carboxaldehyde, 4-hydroxy-1-(2-propenyl)-
CAS No: 109523-70-8 Catalog No: AG007T09 MDL No:
Product Description
Catalog Number:
AG007T09
Chemical Name:
1H-Indole-3-carboxaldehyde, 4-hydroxy-1-(2-propenyl)-
CAS Number:
109523-70-8
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
4-hydroxy-1-prop-2-enylindole-3-carbaldehyde
InChI:
InChI=1S/C12H11NO2/c1-2-6-13-7-9(8-14)12-10(13)4-3-5-11(12)15/h2-5,7-8,15H,1,6H2
InChI Key:
ILTZRTRIEJXBLW-UHFFFAOYSA-N
SMILES:
C=CCn1cc(c2c1cccc2O)C=O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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