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Name	Ditolylethane	EINECS	N/A
CAS No.	27755-15-3	Density	0.967g/cm³
PSA	N/A	LogP	N/A
Solubility	N/A	Melting Point	N/A
Formula	C16H18	Boiling Point	274.3°Cat760mmHg
Molecular Weight	210.34	Flash Point	118.1°C
Transport Information	N/A	Appearance	N/A
Safety	Moderately toxic by ingestion. Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Bibenzyl,ar,ar'-dimethyl- (7CI,8CI); Ethane, ditolyl- (6CI); 1,2-Bistolylethane;Ditolylethane

Ditolylethane Chemical Properties

Molecule structure of Ditolylethane (CAS NO.27755-15-3):

IUPAC Name: 3-Phenylbutan-2-ylbenzene
Molecular Weight: 210.31412 g/mol
Molecular Formula: C₁₆H₁₈
Density: 0.967 g/cm³
Boiling Point: 274.3 °C at 760 mmHg
Flash Point: 118.1 °C
Index of Refraction: 1.552
Molar Refractivity: 69.56 cm³
Molar Volume: 217.4 cm³
Polarizability: 27.57×10^-24 cm³
Surface Tension: 36 dyne/cm
Enthalpy of Vaporization: 49.21 kJ/mol
Vapour Pressure: 0.00913 mmHg at 25 °C
XLogP3-AA: 4.8
Rotatable Bond Count: 3
Exact Mass: 210.140851
MonoIsotopic Mass: 210.140851
Heavy Atom Count: 16
Complexity: 162
Canonical SMILES: CC(C1=CC=CC=C1)C(C)C2=CC=CC=C2
InChI: InChI=1S/C16H18/c1-13(15-9-5-3-6-10-15)14(2)16-11-7-4-8-12-16/h3-14H,1-2H3
InChIKey of Ditolylethane (CAS NO.27755-15-3): NGCFVIRRWORSML-UHFFFAOYSA-N

Ditolylethane Toxicity Data With Reference

1.	orl-mus TDLo:9200 mg/kg/73W-C:ETA	GTPZAB Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 15 (5)(1971),49.
2.	orl-mus LD50:725 mg/kg	GTPZAB Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 15 (5)(1971),49.
3.	scu-mus LD50:10 g/kg	GTPZAB Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 15 (5)(1971),49.

Ditolylethane Safety Profile

Moderately toxic by ingestion. Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.

Ditolylethane Specification

Ditolylethane (CAS NO.27755-15-3) is also named as Ethane, ditolyl- .

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