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1,1',1''-(1-Chloro-1-ethenyl-2-ylidene)tris(benzene)

HCID 87450
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Basic information

CAS
18084-97-4
Standard SMILES
ClC(=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIKey
QEQFTTCZLHLKFX-UHFFFAOYSA-N
Molecular formula
C20H15Cl
Average molar mass
290.8 g/mol
Monoisotopic mass
290.0862282

Overview

RN in Chemline for Br: 1607-57-4; structure

Names & identifiers

Preferred name
1,1',1''-(1-Chloro-1-ethenyl-2-ylidene)tris(benzene)
IUPAC
(1-chloro-2,2-diphenylethenyl)benzene
English name
chlorotriphenylethylene
Molecular formula
C20H15Cl
Molecular weight
290.79

Names & synonyms

18084-97-4ChlorotriphenylethylenePhenylstilbene chlorideAV6NM693EGBenzene, 1,1',1''-(1-chloro-1-ethenyl-2-ylidene)tris-NSC-8092DTXSID801710201,1',1''-(1-CHLORO-1-ETHENYL-2-YLIDENE)TRIS(BENZENE)RefChem:575982DTXCID9093511241-992-7Triphenylchloroethylene
Show more names
1-CHLOROTRIPHENYLETHYLENE1,1,2-Triphenyl-2-chloroethene1,1',1''-(1-Chloroethenyl-2-ylidene)trisbenzene
(1-chloro-2,2-diphenylethenyl)benzeneEthylene, chlorotriphenyl-(2-Chloroethene-1,1,2-triyl)tribenzeneGynosone1-chloro-1,2,2-triphenyletheneNSC 8092EINECS 241-992-7UNII-AV6NM693EG

Database identifiers

CAS
18084-97-4
PubChem CID
87450
DTXSID
DTXSID80171020
UNII
AV6NM693EG
EC Number
241-992-7
Nikkaji
J260.872C

Properties

Computed structural properties

XLogP
6.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
319

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

Physicochemical properties

Melting point
117.5 · 117.5-118.5 °C
Boiling point
182 · 182-185 °C(Press: 2 Torr)
Density
1.145 · 1.145±0.06 g/cm3(Predicted)
FDA UNII
6 NM693EG · AV6NM693EG
Symbol(GHS)
7 · GHS07,GHS09
Signal word
Warning
Hazard statements
335 · H335-H315-H410
Precautionary statements
273 · P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P271, P273, P280, P302+P352, P304+P340, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07,GHS09
Hazard statements
H335-H315-H410
Precautionary statements
P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362

Related reactions

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Compound notes

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