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83824-09-3 | 1H-Indole-1-carboxaldehyde, 3-phenyl-
CAS No: 83824-09-3 Catalog No: AG004W0T MDL No:
Product Description
Catalog Number:
AG004W0T
Chemical Name:
1H-Indole-1-carboxaldehyde, 3-phenyl-
CAS Number:
83824-09-3
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
IUPAC Name:
3-phenylindole-1-carbaldehyde
InChI:
InChI=1S/C15H11NO/c17-11-16-10-14(12-6-2-1-3-7-12)13-8-4-5-9-15(13)16/h1-11H
InChI Key:
ZGFKLMDGVBDNHI-UHFFFAOYSA-N
SMILES:
O=Cn1cc(c2c1cccc2)c1ccccc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.084g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.259g/mol
Monoisotopic Mass:
221.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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