9-Benzylidenefluorene - CAS 1836-87-9

Technical Data

IUPAC Name:	9-benzylidenefluorene
Description:	9-Benzylidenefluorene (CAS# 1836-87-9) is a by-product in the synthesis of Benz[e]acephenanthrylene (B209865). Benz[e]acephenanthrylene is a polycyclic aromatic hydrocarbon that was detected in significant levels in airborne pollutants, auto exhaust and tobacco and marijuana smoke.
Molecular Weight:	254.33
Molecular Formula:	C20H14
Canonical SMILES:	C1=CC=C(C=C1)C=C2C3=CC=CC=C3C4=CC=CC=C42
InChI:	InChI=1S/C20H14/c1-2-8-15(9-3-1)14-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)20/h1-14H
InChI Key:	RMQMLYMBZGDKBY-UHFFFAOYSA-N
Boiling Point:	392.9 °C at 760 mmHg
Density:	1.176 g/cm³
MDL:	MFCD00019092
LogP:	5.25590

Publication Number	Title	Priority Date
CN-113480394-A	Green synthesis method of alkylene fluorene	20210705
US-10273346-B2	Thermoplastic polymer compositions	20150210
US-2016229986-A1	Thermoplastic polymer compositions	20150210
US-2019233614-A1	Thermoplastic polymer compositions	20150210
US-10745538-B2	Thermoplastic polymer compositions	20150210

Complexity:	336
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	254.109550447
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	254.109550447
Rotatable Bond Count:	1
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.1