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N-Benzylcarbazole

HCID 146485
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
19402-87-0
Standard SMILES
c1ccc(Cn2c3ccccc3c3ccccc32)cc1
InChIKey
HBAKJBGOHINNQM-UHFFFAOYSA-N
Molecular formula
C19H15N
Average molar mass
257.3 g/mol
Monoisotopic mass
257.12044948

Overview

structure given in first source

Names & identifiers

Preferred name
N-Benzylcarbazole
IUPAC
9-benzylcarbazole
English name
9-Benzylcarbazole
Molecular formula
C19H15N
Molecular weight
257.33

Names & synonyms

19402-87-0N-BenzylcarbazoleN-(Phenylmethyl)carbazoleDTXSID00173021RefChem:162957DTXCID80955129-Benzyl-9H-carbazole9-Benzylcarbazole9-(Phenylmethyl)-9h-carbazoleMFCD00218286CHEMBL3623230BDBM50123155
Show more names
9-Benzylcarbazole >9-(phenylmethyl)carbazole9H-Carbazole,9-(phenylmethyl)-9-Benzylcarbazole 9-Benzylcarbazole
AKOS000631221CS-W014077AS-57480SY055581B3558EU-0034292SR-01000395592BRD-K19394758-001-01-3

Database identifiers

CAS
19402-87-0
PubChem CID
146485
DTXSID
DTXSID00173021
ChEMBL
CHEMBL3623230
Nikkaji
J390.223D

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
4.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
298

Physicochemical properties

Melting point
122 · 122-123℃
Boiling point
268 °C/24mmHg · 268°C/24mmHg(lit.)
Density
0.9329 · 0.9329 (rough estimate)
refractive index
1.738 · 1.7380 (estimate)
storage temp.
Sealed in dry,Room Temperature
form
powder to crystal
color
White to Almost white
λmax
341 nm · 341nm(MeOH)(lit.)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H320-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
HS Code
2933.99 · 2933.99.8290

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933.99.8290
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H320-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Related reactions

11 records
New reaction record
HRID 91416 reaction equation
HRID 91416As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 142956 reaction equation
HRID 142956As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 188961 reaction equation
HRID 188961As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 192201 reaction equation
HRID 192201As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 222391 reaction equation
HRID 222391As productuspto-grants-2012_06
HRID 659613 reaction equation
HRID 659613As productuspto-grants-2011_12
HRID 659614 reaction equation
HRID 659614As reactantuspto-grants-2011_12
HRID 1361037 reaction equation
HRID 1361037As productuspto-grants-2011_02
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Compound notes

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