6-Nitrobicyclo[2.2.1]hept-2-ene supplier

Name
6-nitrobicyclo[2.2.1]hept-2-ene
EINECS
CAS No. 874-44-2
Article Data6
CAS DataBase
Density 1.21 g/cm³
Solubility
Melting Point
Formula C₇H₉NO₂
Boiling Point 228.5 °C at 760 mmHg
Molecular Weight 139.15
Flash Point 102.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Norbornene,5-nitro-, endo- (8CI);Bicyclo[2.2.1]hept-2-ene, 5-nitro-, endo-;5-endo-Nitrobicyclo[2.2.1]hept-2-ene;5-endo-Nitronorbornene;NSC 16141;NSC92358;endo-5-Nitro-2-norbornene;
PSA 45.82000
LogP 1.75090

6-Nitrobicyclo[2.2.1]hept-2-ene Specification

This chemical is called 6-Nitrobicyclo[2.2.1]hept-2-ene, and its systematic name is 5-nitrobicyclo[2.2.1]hept-2-ene. With the molecular formula of C₇H₉NO₂, its molecular weight is 139.15. The CAS registry number of this chemical is 874-44-2.

Other characteristics of the 6-Nitrobicyclo[2.2.1]hept-2-ene can be summarised as followings: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 45.82 Å²; (7)Index of Refraction: 1.545; (8)Molar Refractivity: 36.24 cm³; (9)Molar Volume: 114.5 cm³; (10)Polarizability: 14.37×10^-24cm³; (11)Surface Tension: 42 dyne/cm; (12)Density: 1.21 g/cm³; (13)Flash Point: 102.6 °C; (14)Enthalpy of Vaporization: 46.51 kJ/mol; (15)Boiling Point: 228.5 °C at 760 mmHg; (16)Vapour Pressure: 0.0731 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=[N+]([O-])C2C1\C=C/C(C1)C2
2.InChI: InChI=1/C7H9NO2/c9-8(10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2
3.InChIKey: DXTVIYLGTPEMKI-UHFFFAOYAG
4.Std. InChI: InChI=1S/C7H9NO2/c9-8(10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2
5.Std. InChIKey: DXTVIYLGTPEMKI-UHFFFAOYSA-N

Product Name

6-nitrobicyclo[2.2.1]hept-2-ene

6-Nitrobicyclo[2.2.1]hept-2-ene Specification

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