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Home > Aldehydes > 893738-42-6
893738-42-6 | 5-(4-Tert-butylphenyl)-1H-indole-3-carbaldehyde
CAS No: 893738-42-6 Catalog No: AG01EYPH MDL No:
Product Description
Catalog Number:
AG01EYPH
Chemical Name:
5-(4-Tert-butylphenyl)-1H-indole-3-carbaldehyde
CAS Number:
893738-42-6
Molecular Formula:
C19H19NO
Molecular Weight:
277.3603
IUPAC Name:
5-(4-tert-butylphenyl)-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C19H19NO/c1-19(2,3)16-7-4-13(5-8-16)14-6-9-18-17(10-14)15(12-21)11-20-18/h4-12,20H,1-3H3
InChI Key:
OMXFUMVOJTUAIY-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cc(cc2)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.147g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.367g/mol
Monoisotopic Mass:
277.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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