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Home > Aldehydes > 313479-66-2
313479-66-2 | 1H-Indole-5-carboxaldehyde, 1-butyl-2,3-dihydro-
CAS No: 313479-66-2 Catalog No: AG007HJP MDL No:
Product Description
Catalog Number:
AG007HJP
Chemical Name:
1H-Indole-5-carboxaldehyde, 1-butyl-2,3-dihydro-
CAS Number:
313479-66-2
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
IUPAC Name:
1-butyl-2,3-dihydroindole-5-carbaldehyde
InChI:
InChI=1S/C13H17NO/c1-2-3-7-14-8-6-12-9-11(10-15)4-5-13(12)14/h4-5,9-10H,2-3,6-8H2,1H3
InChI Key:
VWFUZSFVSZMSNV-UHFFFAOYSA-N
SMILES:
CCCCN1CCc2c1ccc(c2)C=O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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