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Home > Aldehydes > 192997-34-5
192997-34-5 | 1-(4-methylbenzyl)-1H-indole-6-carbaldehyde
CAS No: 192997-34-5 Catalog No: AG00ACV1 MDL No:MFCD09455251
Product Description
Catalog Number:
AG00ACV1
Chemical Name:
1-(4-methylbenzyl)-1H-indole-6-carbaldehyde
CAS Number:
192997-34-5
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
MDL Number:
MFCD09455251
IUPAC Name:
1-[(4-methylphenyl)methyl]indole-6-carbaldehyde
InChI:
InChI=1S/C17H15NO/c1-13-2-4-14(5-3-13)11-18-9-8-16-7-6-15(12-19)10-17(16)18/h2-10,12H,11H2,1H3
InChI Key:
KAMDPYAYPGSDBC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)n(cc2)Cc1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.115g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.313g/mol
Monoisotopic Mass:
249.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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