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Home > Aldehydes > 803712-70-1
803712-70-1 | 5-(1H-Indol-2-yl)-3-methoxy-1H-pyrrole-2-carbaldehyde
CAS No: 803712-70-1 Catalog No: AG0053MT MDL No:
Product Description
Catalog Number:
AG0053MT
Chemical Name:
5-(1H-Indol-2-yl)-3-methoxy-1H-pyrrole-2-carbaldehyde
CAS Number:
803712-70-1
Molecular Formula:
C14H12N2O2
Molecular Weight:
240.2573
IUPAC Name:
5-(1H-indol-2-yl)-3-methoxy-1H-pyrrole-2-carbaldehyde
InChI:
InChI=1S/C14H12N2O2/c1-18-14-7-12(16-13(14)8-17)11-6-9-4-2-3-5-10(9)15-11/h2-8,15-16H,1H3
InChI Key:
LBTFRKGKBJBBFY-UHFFFAOYSA-N
SMILES:
O=Cc1[nH]c(cc1OC)c1cc2c([nH]1)cccc2
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.262g/mol
Monoisotopic Mass:
240.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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