CAS No.605644-46-0,9,9-Dimethyl-2-nitro-9H-fluorene Suppliers

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Basic Information

Molecular Structure:
CAS No.:	605644-46-0
Name:	9,9-Dimethyl-2-nitro-9H-fluorene

Formula:	C₁₅H₁₃NO₂
Molecular Weight:	239.274
Synonyms:	9,9-dimethyl-2-nitro-9H-fluorene;
EINECS:	1533716-785-6
Density:	1.205 g/cm³
Melting Point:	100-104℃
Boiling Point:	373.133 °C at 760 mmHg
Flash Point:	171.829 °C
PSA:	45.82000
LogP:	4.42430

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Specification

This chemical is called 9,9-Dimethyl-2-nitrofluorene, and its CAS registry number is 605644-46-0. With the molecular formula of C₁₅H₁₃NO₂, its molecular weight is 239.27. Additionally, its product category is Fluorene Derivatives. Its systematic name is called 9,9-dimethyl-2-nitro-fluorene.

Other characteristics of the 9,9-Dimethyl-2-nitrofluorene can be summarised as followings: (1)ACD/LogP: 4.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.958; (4)ACD/LogD (pH 7.4): 4.958; (5)ACD/BCF (pH 5.5): 3452.803; (6)ACD/BCF (pH 7.4): 3452.803; (7)ACD/KOC (pH 5.5): 11863.636; (8)ACD/KOC (pH 7.4): 11863.636; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.82 Å²; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 69.663 cm³; (15)Molar Volume: 198.589 cm³; (16)Polarizability: 27.616×10^-24cm³; (17)Surface Tension: 48.957 dyne/cm; (18)Density: 1.205 g/cm³; (19)Flash Point: 171.829 °C; (20)Enthalpy of Vaporization: 59.601 kJ/mol; (21)Boiling Point: 373.133 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CC1(c2ccccc2-c3c1cc(cc3)[N+](=O)[O-])C
2.InChI: InChI=1/C15H13NO2/c1-15(2)13-6-4-3-5-11(13)12-8-7-10(16(17)18)9-14(12)15/h3-9H,1-2H3
3.InChIKey: SPNVINZCDHRVAI-UHFFFAOYAE