1H-Perimidine-2(3H)-thione supplier

Name
1H,3H-PERIMIDINE-2-THIONE
EINECS
CAS No. 30837-62-8
Article Data18
CAS DataBase
Density 1.4 g/cm³
Solubility
Melting Point
Formula C₁₁H₈N₂S
Boiling Point 393.2 °C at 760 mmHg
Molecular Weight 200.264
Flash Point 191.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Perimidine-2-thiol(8CI);1,3-(1,8-Naphthylene)thiourea;2-Mercapto-1H-perimidine;2-Mercaptoperimidine;Thioperimidone;1,3-(1,8-Naphthylene)-2-thiourea;Perimidine-2(3H)-thione;Thiourea, N,N'-(1,8-naphthalenediyl)-;
PSA 67.48000
LogP 3.00480

1H-Perimidine-2(3H)-thione Specification

The 1H-Perimidine-2(3H)-thione is an organic compound with the formula C₁₁H₈N₂S. The IUPAC name of this chemical is 2-propan-2-ylpent-4-enamide. With the CAS registry number 30837-62-8, it is also named as 1H,3H-Perimidine-2-thione.

Physical properties about 1H-Perimidine-2(3H)-thione are: (1)ACD/LogP: 1.68; (2)ACD/LogD (pH 5.5): 0.41; (3)ACD/LogD (pH 7.4): 0.41; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.31; (7)ACD/KOC (pH 7.4): 3.3; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)Polar Surface Area: 38.57 Å²; (11)Index of Refraction: 1.81; (12)Molar Refractivity: 61.3 cm³; (13)Molar Volume: 142 cm³; (14)Polarizability: 24.3×10^-24cm³; (15)Surface Tension: 76.6 dyne/cm; (16)Density: 1.4 g/cm³; (17)Flash Point: 191.6 °C; (18)Enthalpy of Vaporization: 64.31 kJ/mol; (19)Boiling Point: 393.2 °C at 760 mmHg; (20)Vapour Pressure: 2.17E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C3Nc2cccc1cccc(c12)N3
(2)InChI: InChI=1/C11H8N2S/c14-11-12-8-5-1-3-7-4-2-6-9(13-11)10(7)8/h1-6H,(H2,12,13,14)
(3)InChIKey: ZASDGLJUXIVFDL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C11H8N2S/c14-11-12-8-5-1-3-7-4-2-6-9(13-11)10(7)8/h1-6H,(H2,12,13,14)
(5)Std. InChIKey: ZASDGLJUXIVFDL-UHFFFAOYSA-N

Product Name

1H,3H-PERIMIDINE-2-THIONE

1H-Perimidine-2(3H)-thione Specification

Related Products

Hot Products