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9-Ethyl-3-ethynyl-9H-carbazole

HCID 53427876
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Basic information

CAS
102792-38-1
Standard SMILES
C#Cc1ccc2c(c1)c1ccccc1n2CC
InChIKey
GSABLKFBUDPGEP-UHFFFAOYSA-N
Molecular formula
C16H13N
Average molar mass
219.28 g/mol
Monoisotopic mass
219.10479942

Names & identifiers

Preferred name
9-Ethyl-3-ethynyl-9H-carbazole
IUPAC
9-ethyl-3-ethynylcarbazole
English name
9-Ethyl-3-ethynyl-9H-carbazole
Molecular formula
C16H13N
Molecular weight
219.28

Names & synonyms

9-ETHYL-3-ETHYNYL-9H-CARBAZOLE102792-38-1DTXSID50699665RefChem:313098DTXCID106504149-ethyl-3-ethynylcarbazole9H-Carbazole, 9-ethyl-3-ethynyl-9-ethyl-3-ethynyl-carbazoleSCHEMBL1052731G70750A1-151869-ethyl-9H-carbazol-3-yl-ethyne

Database identifiers

CAS
102792-38-1
PubChem CID
53427876
DTXSID
DTXSID50699665
Nikkaji
J1.580.140I

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
4.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
326

Physicochemical properties

Boiling point
325.7 · 325.7±24.0 °C(Predicted)
Density
1.02 · 1.02±0.1 g/cm3(Predicted)

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