Acenaphthylene

Catalog Number	ACM208968-1
CAS	208-96-8
Structure
Synonyms	Cyclopenta[de]naphthalene
IUPAC Name	acenaphthylene
Molecular Weight	152.19
Molecular Formula	C12H8
Canonical SMILES	C1=CC2=C3C(=C1)C=CC3=CC=C2;
InChI	HXGDTGSAIMULJN-UHFFFAOYSA-N
InChI Key	InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
Boiling Point	280 °C(lit.)
Melting Point	78-82 °C(lit.)
Flash Point	122°C
Purity	99%
Density	0.899 g/cm3 at 25 °C(lit.)
Solubility	Insoluble (NTP, 1992);1.06e-04 M;In water, 3.93 mg/L at 25 deg C;In water, 9 mg/L at 25 deg C (OECD Guideline 105);Very soluble in ethanol, ether, benzene; slightly soluble in chloroform;
Appearance	Solid
Application	Polycyclic aromatic hydrocarbons as carcinogenic
Storage	APPROX 4°C
Complexity	184
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
EC Number	205-917-1
Exact Mass	152.0626
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isomeric SMILES	C1=CC2=C3C(=C1)C=CC3=CC=C2
Monoisotopic Mass	152.0626
Rotatable Bond Count	0
Topological Polar Surface Area	0 Ų