3-Iodo-N-phenylcarbazole

• CAS: 502161-03-7
• Catalog Number: ACM502161037-2
• Category: Other Products
• Molecular Weight: 369.2
• Molecular Formula: C18H12IN
• Synonyms: 3-Iodo-N-phenylcarbazole;3-Iodo-9-phenylcarbazole;3-iodo-9-phenyl-9H-carbazole;3-iodo-N-phenylcarbazol
• IUPAC Name: 3-iodo-9-phenylcarbazole
• Canonical SMILES: C1=CC=C(C=C1)N2C3=C(C=C(C=C3)I)C4=CC=CC=C42
• InChI: InChI=1S/C18H12IN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H
• InChI Key: PJUAIXDOXUXBDR-UHFFFAOYSA-N
• Boiling Point: 103.0 - 107.0 °C
• Melting Point: 480.6 ± 27.0 °C
• Density: 1.55 ± 0.1 g/ml
• Complexity: 338
• Covalently-Bonded Unit Count: 1
• Exact Mass: 369.00145g/mol
• Formal Charge: 0
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 20
• Monoisotopic Mass: 369.00145g/mol
• Rotatable Bond Count: 1
• XLogP3: 5.6

Synthetic Use

Upstream Synthesis Route 1

• 1150-62-5

• 57103-21-6
• 502161-03-7

Reference: [1] Journal of Heterocyclic Chemistry, 2002, vol. 39, # 5, p. 933 - 941
[2] Journal of Heterocyclic Chemistry, 2002, vol. 39, # 5, p. 933 - 941
[3] Tetrahedron Letters, 2006, vol. 47, # 39, p. 6957 - 6960

Upstream Synthesis Route 2

• 1150-62-5

• 502161-03-7

Reference: [1] Patent: EP1661888, 2006, A1, . Location in patent: Page/Page column 11

Upstream Synthesis Route 3

• 86-74-8

• 502161-03-7

Reference: [1] Patent: KR2016/19744, 2016, A,

Upstream Synthesis Route 4

• 1150-62-5

• 57103-21-6
• 502161-03-7

Reference: [1]Journal of Heterocyclic Chemistry,2002,vol. 39,p. 933 - 941
[2]Journal of Heterocyclic Chemistry,2002,vol. 39,p. 933 - 941
[3]Tetrahedron Letters,2006,vol. 47,p. 6957 - 6960

Downstream Synthesis Route 1

• 873-74-5
• 502161-03-7

• 873793-84-1

Reference: [1]Patent: EP1661888,2006,A1 .Location in patent: Page/Page column 12-13

* For details of the synthesis route, please refer to the original source to ensure accuracy.