6,6'-Diphenylfulvene

HCID 101236

Basic information

CAS
2175-90-8
Standard SMILES
C1=CC(=C(c2ccccc2)c2ccccc2)C=C1
InChIKey
BULLHRADHZGONG-UHFFFAOYSA-N
Molecular formula
C18H14
Average molar mass
230.3 g/mol
Monoisotopic mass
230.10955045

Names & identifiers

Preferred name
6,6'-Diphenylfulvene
IUPAC
[cyclopenta-2,4-dien-1-ylidene(phenyl)methyl]benzene
English name
DIPHENYLFULVENE
Molecular formula
C18H14
Molecular weight
230.3

Names & synonyms

6,6-DiphenylfulveneDiphenylfulvene6,6'-DiphenylfulveneDiphenylmethylidene cyclopentadiene6,6-DiphenylpentafulveneBenzene, 1,1'-(2,4-cyclopentadien-1-ylidenemethylene)bis-I8CJ7P33G3Fulvene, 6,6-diphenylNSC 402188NSC-402188UNII-I8CJ7P33G3DTXSID50176148
Show more names
Diphenyl rich eneDiphenylfulvene 98%6,6-DIOHENYLFULVENE6,6'-Diphenylfulven6,6-Diphenylfulvene>Diphenylmethylidene cyclopentadiene
FULVENE, 6,6-DIPHENYL-EINECS 218-533-4(2-(CYCLOPENTA-2,4-DIENYLIDENE)PROPANE-1,3-DIYL)DIBENZENE1,1'-(2,4-CYCLOPENTADIEN-1-YLIDENEMETHYLENE)BIS(BENZENE)[2-(Cyclopenta-2,4-dienylidene)propane-1,3-diyl]dibenzeneRefChem:103744DTXCID00986395(Diphenylmethylene)1,3cyclopentadiene

Database identifiers

CAS
2175-90-8
PubChem CID
101236
DTXSID
DTXSID50176148
UNII
I8CJ7P33G3
EC Number
218-533-4
Nikkaji
J13.870C

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
18

Experimental & physicochemical properties

Physical DescriptionSolid; [Sigma-Aldrich MSDS]

Physicochemical properties

Melting point
81.5 · 81.5-83 °C (lit.)
Boiling point
307.3 °C · 307.3°C (rough estimate)
Density
1.0829 · 1.0829 (estimate)
vapor pressure
0.033 · 0.033-0.084Pa at 25℃
refractive index
1.55 · 1.5500 (estimate)
storage temp.
Refrigerator

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified;Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 3 of 3 reports by companies.;There are 0 notifications provided by 0 of 3 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory Information · 2 items

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 14-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24946

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS] See Diphenylmethane.
Hazard Classes and CategoriesNot Classified

Regulatory information

Regulatory Information · 2 items

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 14-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24946

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
hs_code
2902.90.9000
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzene, 1,1'-(2,4-cyclopentadien-1-ylidenemethylene)bis-: ACTIVE

Applications

Uses6,6-Diphenylfulvene is a useful research chemical.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

Related reactions

9 records

Compound notes

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