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923293-04-3

923293-04-3 | 2-Propenal, 3-(5-methoxy-1H-indol-3-yl)-, (2E)-

CAS No: 923293-04-3 Catalog No: AG0067PG MDL No:

Product Description

Catalog Number:
AG0067PG
Chemical Name:
2-Propenal, 3-(5-methoxy-1H-indol-3-yl)-, (2E)-
CAS Number:
923293-04-3
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
3-(5-methoxy-1H-indol-3-yl)prop-2-enal
InChI:
InChI=1S/C12H11NO2/c1-15-10-4-5-12-11(7-10)9(8-13-12)3-2-6-14/h2-8,13H,1H3
InChI Key:
ONSRRKPJZKYJJU-UHFFFAOYSA-N
SMILES:
O=C/C=C/c1c[nH]c2c1cc(OC)cc2

Properties

Complexity:
252  
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:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.9  

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