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Home > Aldehydes > 893734-12-8
893734-12-8 | 5-(2,3-Dihydro-1H-indol-5-yl)-2-thiophenecarbaldehyde
CAS No: 893734-12-8 Catalog No: AG01EYK6 MDL No:
Product Description
Catalog Number:
AG01EYK6
Chemical Name:
5-(2,3-Dihydro-1H-indol-5-yl)-2-thiophenecarbaldehyde
CAS Number:
893734-12-8
Molecular Formula:
C13H11NOS
Molecular Weight:
229.2975
IUPAC Name:
5-(2,3-dihydro-1H-indol-5-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C13H11NOS/c15-8-11-2-4-13(16-11)10-1-3-12-9(7-10)5-6-14-12/h1-4,7-8,14H,5-6H2
InChI Key:
VCRMJIQLDFBYAM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1ccc2c(c1)CCN2
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.056g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.297g/mol
Monoisotopic Mass:
229.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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