1-Pyrenecarbonitrile supplier

Name
pyrene-1-carbonitrile
EINECS
CAS No. 4107-64-6
Article Data1
CAS DataBase
Density 1.29 g/cm³
Solubility
Melting Point
Formula C₁₇H₉N
Boiling Point 446 °C at 760 mmHg
Molecular Weight 227.265
Flash Point 225.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Cyanopyrene;3-Pyrenecarbonitrile;
PSA
LogP

1-Pyrenecarbonitrile Specification

The CAS register number of 1-Pyrenecarbonitrile is 4107-64-6. It also can be called as 1-Cyanopyrene and the IUPAC name about this chemical is pyrene-1-carbonitrile. The molecular formula about this chemical is C₁₇H₉N and the molecular weight is 227.2601.

Physical properties about 1-Pyrenecarbonitrile are: (1)ACD/LogP: 4.61; (2)ACD/LogD (pH 5.5): 4.61; (3)ACD/LogD (pH 7.4): 4.61; (4)ACD/BCF (pH 5.5): 1869.81; (5)ACD/BCF (pH 7.4): 1869.81; (6)ACD/KOC (pH 5.5): 7648.02; (7)ACD/KOC (pH 7.4): 7648.02; (8)#H bond acceptors: 1; (9)Polar Surface Area: 23.79Å²; (10)Index of Refraction: 1.817; (11)Molar Refractivity: 76.24 cm³; (12)Molar Volume: 175.4 cm³; (13)Polarizability: 30.22x10^-24cm³; (14)Surface Tension: 65.5 dyne/cm; (15)Flash Point: 225.2 °C; (16)Enthalpy of Vaporization: 70.41 kJ/mol; (17)Boiling Point: 446 °C at 760 mmHg; (18)Vapour Pressure: 3.76E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc4ccc2ccc1cccc3c1c2c4cc3
(2)InChI: InChI=1/C17H9N/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9H
(3)InChIKey: LLSYZMNMWXDYMT-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C17H9N/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9H
(5)Std. InChIKey: LLSYZMNMWXDYMT-UHFFFAOYSA-N

Product Name

pyrene-1-carbonitrile

1-Pyrenecarbonitrile Specification

Related Products

Hot Products