Carbazole, 1,4,9-trimethyl-
PubChem CID
146420
Structure
Molecular Formula
Synonyms
- 1,4,9-Trimethylcarbazole
- 18024-11-8
- Carbazole, 1,4,9-trimethyl-
- 1,4,9-trimethyl-9H-carbazole
- 9H-Carbazole, 1,4,9-trimethyl-
Molecular Weight
209.29 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-07-19
- Modify:2025-01-18
Chemical Structure Depiction
1,4,9-trimethylcarbazole
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C15H15N/c1-10-8-9-11(2)15-14(10)12-6-4-5-7-13(12)16(15)3/h4-9H,1-3H3
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
RHNKXMFRUHICPK-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CC1=C2C3=CC=CC=C3N(C2=C(C=C1)C)C
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C15H15N
Computed by PubChem 2.2 (PubChem release 2021.10.14)
18024-11-8
- 1,4,9-Trimethylcarbazole
- 18024-11-8
- Carbazole, 1,4,9-trimethyl-
- 1,4,9-trimethyl-9H-carbazole
- 9H-Carbazole, 1,4,9-trimethyl-
- 9H-Carbazole, 1,4,9-trimethyl- (9CI)
- CCRIS 8636
- DTXSID00170934
- 7U3C9D5VBD
- MLS000861452
- CHEMBL1532671
- DTXCID0093425
- SCHEMBL21793460
- HMS1667O15
- HMS2808I10
- CCG-49162
- NCGC00246689-01
- 9H-Carbazole, 1,4,9-trimethyl-(9CI)
- SMR000460236
- SR-01000638638-1
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
209.29 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3-AA
Property Value
4.1
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
209.120449483 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
209.120449483 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
4.9 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
16
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
262
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
1.1 [ug/mL] (The mean of the results at pH 7.4)
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Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=RHNKXMFRUHICPK-UHFFFAOYSA-N
- Burnham Center for Chemical Genomics
- ChEMBLLICENSEAccess to the web interface of ChEMBL is made under the EBI's Terms of Use (http://www.ebi.ac.uk/Information/termsofuse.html). The ChEMBL data is made available on a Creative Commons Attribution-Share Alike 3.0 Unported License (http://creativecommons.org/licenses/by-sa/3.0/).http://www.ebi.ac.uk/Information/termsofuse.html
- ChemIDplusCarbazole, 1,4,9-trimethyl-https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0018024118ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- EPA DSSToxCarbazole, 1,4,9-trimethyl-https://comptox.epa.gov/dashboard/DTXSID00170934CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- FDA Global Substance Registration System (GSRS)LICENSEUnless otherwise noted, the contents of the FDA website (www.fda.gov), both text and graphics, are not copyrighted. They are in the public domain and may be republished, reprinted and otherwise used freely by anyone without the need to obtain permission from FDA. Credit to the U.S. Food and Drug Administration as the source is appreciated but not required.https://www.fda.gov/about-fda/about-website/website-policies#linking1,4,9-Trimethylcarbazolehttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/7U3C9D5VBD
- Japan Chemical Substance Dictionary (Nikkaji)
- SpectraBase1,4,9-Trimethyl-carbazolehttps://spectrabase.com/spectrum/3YzwzVRjS6g
- WikidataCarbazole, 1,4,9-trimethyl-https://www.wikidata.org/wiki/Q83040954
- PubChem
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 433996114https://pubchem.ncbi.nlm.nih.gov/substance/433996114
CONTENTS