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Structure

7H-benzo[c]carbazole

CAS
205-25-4
Catalog Number
ACM205254-2
Category
Main Products
Molecular Weight
217.27
Molecular Formula
C16H11N

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Specification

Synonyms
3,4-Benzocarbazole
IUPAC Name
7H-benzo[c]carbazole
Canonical SMILES
C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4N3
InChI
InChI=1S/C16H11N/c1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15/h1-10,17H
InChI Key
UGFOTZLGPPWNPY-UHFFFAOYSA-N
Boiling Point
347.8 ºC
Melting Point
135-137 ºC
Density
1.277 g/ml
Appearance
Solid
Complexity
287
Covalently-Bonded Unit Count
1
EC Number
205-909-8
Exact Mass
217.089149g/mol
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
1
Heavy Atom Count
17
Isomeric SMILES
C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4N3
Monoisotopic Mass
217.089149g/mol
NSC Number
108995
Rotatable Bond Count
0
UNII
J2W3Z6C2NQ
XLogP3
5
What is the molecular formula of 7H-benzo[c]carbazole?

The molecular formula of 7H-benzo[c]carbazole is C16H11N.

What is the molecular weight of 7H-benzo[c]carbazole?

The molecular weight of 7H-benzo[c]carbazole is 217.26 g/mol.

What are the synonyms of 7H-benzo[c]carbazole?

The synonyms of 7H-benzo[c]carbazole include 3,4-Benzocarbazole, 7H-Benzo(c)carbazole, and 7-Aza-7H-benzo(c)fluorene.

What is the IUPAC name of 7H-benzo[c]carbazole?

The IUPAC name of 7H-benzo[c]carbazole is 7H-benzo[c]carbazole.

What is the InChI of 7H-benzo[c]carbazole?

The InChI of 7H-benzo[c]carbazole is InChI=1S/C16H11N/c1-2-6-12-11(5-1)9-10-15-16(12)13-7-3-4-8-14(13)17-15/h1-10,17H.

What is the InChIKey of 7H-benzo[c]carbazole?

The InChIKey of 7H-benzo[c]carbazole is UGFOTZLGPPWNPY-UHFFFAOYSA-N.

What is the canonical SMILES of 7H-benzo[c]carbazole?

The canonical SMILES of 7H-benzo[c]carbazole is C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4N3.

What is the CAS number of 7H-benzo[c]carbazole?

The CAS number of 7H-benzo[c]carbazole is 205-25-4.

What are the other identifiers of 7H-benzo[c]carbazole?

The other identifiers of 7H-benzo[c]carbazole include European Community (EC) Number (205-909-8), NSC Number (108995), UNII (J2W3Z6C2NQ), DSSTox Substance ID (DTXSID00174477), Nikkaji Number (J193.678F), and Wikidata (Q72445366).

What is the XLogP3 value of 7H-benzo[c]carbazole?

The XLogP3 value of 7H-benzo[c]carbazole is 5.

Upstream Synthesis Route 1

  • 5425-53-6
  • 205-25-4

Reference: [1]Patent: EP2332911,2011,A2 .Location in patent: Page/Page column 59; 60

Upstream Synthesis Route 2

  • 854161-68-5
  • 243-28-7
  • 205-25-4

Reference: [1]Justus Liebigs Annalen der Chemie,1950,vol. 566,p. 162,179

Upstream Synthesis Route 3

  • 854161-86-7
  • 243-28-7
  • 205-25-4

Reference: [1]Justus Liebigs Annalen der Chemie,1950,vol. 566,p. 162,179

Downstream Synthesis Route 1

  • 205-25-4
  • 1698-16-4

Reference: [1] Patent: WO2013/32297, 2013, A1, . Location in patent: Paragraph 147; 148

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

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