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94769-48-9 | 9H-Carbazole, 9-(1-butenyl)-3-iodo-
CAS No: 94769-48-9 Catalog No: AG0068GT MDL No:
Product Description
Catalog Number:
AG0068GT
Chemical Name:
9H-Carbazole, 9-(1-butenyl)-3-iodo-
CAS Number:
94769-48-9
Molecular Formula:
C16H14IN
Molecular Weight:
347.1935
IUPAC Name:
9-but-1-enyl-3-iodocarbazole
InChI:
InChI=1S/C16H14IN/c1-2-3-10-18-15-7-5-4-6-13(15)14-11-12(17)8-9-16(14)18/h3-11H,2H2,1H3
InChI Key:
NPBLSXHASQPDSA-UHFFFAOYSA-N
SMILES:
CCC=Cn1c2ccc(cc2c2c1cccc2)I
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.017g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.199g/mol
Monoisotopic Mass:
347.017g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.2
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