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2-(Nitromethylene)thiazolidine

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Name

2-(Nitromethylene)thiazolidine

EINECS N/A
CAS No. 66357-40-2 Density 1.495 g/cm3
PSA 83.15000 LogP 1.25040
Solubility N/A Melting Point 141-143°C
Formula C4H6N2O2S Boiling Point 278.2 °C at 760 mmHg
Molecular Weight 146.17 Flash Point 122 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 66357-40-2 (2-NITROMETHYLENETHIAZOLIDINE) Hazard Symbols N/A
Synonyms

Thiazolidine, 2-(nitromethylene)-;

Article Data 17

2-(Nitromethylene)thiazolidine Specification

The cas register number of 2-(Nitromethylene)thiazolidine is 66357-40-2. It also can be called as Thiazolidine, 2-(nitromethylene)- and the IUPAC Name about this chemical is (2E)-2-(nitromethylidene)-1,3-thiazolidine. It belongs to the Oxime.

Physical properties about 2-(Nitromethylene)thiazolidine are: (1)ACD/LogP: -0.04; (2)ACD/LogD (pH 5.5): -0.04; (3)ACD/LogD (pH 7.4): -0.04; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 22.55; (7)ACD/KOC (pH 7.4): 22.55; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 74.36Å2; (12)Index of Refraction: 1.696; (13)Molar Refractivity: 37.61 cm3; (14)Molar Volume: 97.7 cm3; (15)Polarizability: 14.91x10-24cm3; (16)Surface Tension: 71.3 dyne/cm; (17)Enthalpy of Vaporization: 51.68 kJ/mol; (18)Vapour Pressure: 0.00433 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CSC(=C[N+](=O)[O-])N1
(2)Isomeric SMILES: C1CS/C(=C/[N+](=O)[O-])/N1
(3)InChI: InChI=1S/C4H6N2O2S/c7-6(8)3-4-5-1-2-9-4/h3,5H,1-2H2/b4-3+
(4)InChIKey: IDEZECZCLMOIJN-ONEGZZNKSA-N

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