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N-9H-Fluoren-2-ylbenzamide

HCID 77240
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3671-78-1
Standard SMILES
O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccccc1
InChIKey
MEZOSXXWXWNPDU-UHFFFAOYSA-N
Molecular formula
C20H15NO
Average molar mass
285.3 g/mol
Monoisotopic mass
285.1153641

Overview

structure given in first source

Names & identifiers

Preferred name
N-9H-Fluoren-2-ylbenzamide
IUPAC
N-(9H-fluoren-2-yl)benzamide
English name
N-2-fluorenylbenzamide
Molecular formula
C20H15NO
Molecular weight
285.34

Names & synonyms

N-2-Fluorenylbenzamide3671-78-1N-Fluoren-2-ylbenzamideN-9H-Fluoren-2-ylbenzamideN-(2-fluorenyl)benzamideDTXSID40190176RefChem:162467DTXCID50112667N-(9H-fluoren-2-yl)benzamide2-BenzoylaminofluoreneBenzamide, N-fluoren-2-yl-CCRIS 2765
Show more names
Benzamide, N-9H-fluoren-2-yl-BRN 2812753N-benzoyl-2-aminofluoreneOprea1_688507Oprea1_850940CHEMBL312812SCHEMBL3363253STL388991

Database identifiers

CAS
3671-78-1
PubChem CID
77240
DTXSID
DTXSID40190176
ChEMBL
CHEMBL312812
Nikkaji
J35.266G

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
401

Physicochemical properties

Melting point
215 °C · 215 °C
Boiling point
427.77 °C · 427.77°C (rough estimate)
Density
1.1281 · 1.1281 (rough estimate)
refractive index
1.518 · 1.5180 (estimate)
pka
13.28 · 13.28±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

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

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Ethyl benzoate2-Nitrofluorene

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes