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4310-42-3

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Basic Information
CAS No.: 4310-42-3
Name: 1-(3-NITROPHENYL)-1H-PYRROLE
Article Data: 18
Cas Database
Molecular Structure:
Molecular Structure of 4310-42-3 (1-(3-NITROPHENYL)-1H-PYRROLE)
Formula: C10H8N2O2
Molecular Weight: 188.186
Synonyms: Pyrrole,1-(m-nitrophenyl)- (7CI,8CI);1-(3-Nitrophenyl)pyrrole;1-(m-Nitrophenyl)pyrrole;NSC 116808;
Density: 1.23 g/cm3
Melting Point: 72 °C
Boiling Point: 319.8 °C at 760 mmHg
Flash Point: 147.2 °C
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 50.75000
LogP: 2.90870
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Specification

The 1H-Pyrrole,1-(3-nitrophenyl)- is an organic compound with the formula C10H8N2O2. The IUPAC name of this chemical is 1-(3-Nitrophenyl)pyrrole. With the CAS registry number 4310-42-3, it is also named as (3-Nitrophenyl)pyrrole. Besides, its molecular weight is 188.18.

Physical properties about 1H-Pyrrole,1-(3-nitrophenyl)- are: (1)ACD/LogP: 2.81; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 50.75 Å2; (5)Index of Refraction: 1.613; (6)Molar Refractivity: 53.14 cm3; (7)Molar Volume: 152.6 cm3; (8)Polarizability: 21.06×10-24 cm3; (9)Surface Tension: 52.2 dyne/cm; (10)Density: 1.23 g/cm3; (11)Flash Point: 147.2 °C; (12)Enthalpy of Vaporization: 53.91 kJ/mol; (13)Boiling Point: 319.8 °C at 760 mmHg; (14)Vapour Pressure: 0.000619 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. 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)InChI: InChI=1/C10H8N2O2/c13-12(14)10-5-3-4-9(8-10)11-6-1-2-7-11/h1-8H
(2)InChIKey: GTWSUEQDVMZTRP-UHFFFAOYAS
(3)Std. InChI: InChI=1S/C10H8N2O2/c13-12(14)10-5-3-4-9(8-10)11-6-1-2-7-11/h1-8H
(4)Std. InChIKey: GTWSUEQDVMZTRP-UHFFFAOYSA-N