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7507-40-6

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Basic Information
CAS No.: 7507-40-6
Name: 9H-FLUORENE-2-CARBOXYLIC ACID
Molecular Structure:
Molecular Structure of 7507-40-6 (9H-FLUORENE-2-CARBOXYLIC ACID)
Formula: C14H10O2
Molecular Weight: 210.232
Synonyms: Fluorene-2-carboxylicacid (6CI,7CI,8CI);2-Carboxyfluorene;NSC 407976;
Density: 1.306 g/cm3
Boiling Point: 429.4 °C at 760 mmHg
Flash Point: 191.2 °C
PSA: 37.30000
LogP: 2.95600
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Specification

The 9H-Fluorene-2-carboxylicacid with CAS registry number of 7507-40-6 is also called Fluorene-2-carboxylic acid. It belongs to categories of Carboxylic Acids; Carboxylic Acids; Fused Ring Systems. Its IUPAC name is 9H-fluorene-2-carboxylic acid.

Physical properties about this chemical are: (1) ACD/LogP: 3.84; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 2.59; (4) ACD/LogD (pH 7.4): 1; (5) ACD/BCF (pH 5.5): 27.58; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 165.24; (8) ACD/KOC (pH 7.4): 4.24; (9) #H bond acceptors: 2; (10) #H bond donors: 1; (11) #Freely Rotating Bonds: 1; (12) Polar Surface Area: 26.3 Å2; (13) Index of Refraction: 1.679; (14) Molar Refractivity: 60.72 cm3; (15) Molar Volume: 160.8 cm3; (16) Polarizability: 24.07×10-24 cm3; (17) Surface Tension: 60.6 dyne/cm; (18) Density: 1.306 g/cm3; (19) Flash Point: 191.2 °C; (20) Enthalpy of Vaporization: 72.18 kJ/mol; (21) Boiling Point: 429.4 °C at 760 mmHg; (22) Vapour Pressure: 3.87E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c3ccc2c1ccccc1Cc2c3;
(2) InChI: InChI=1/C14H10O2/c15-14(16)10-5-6-13-11(8-10)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H,15,16);
(3) InChIKey: IBIDFEWDKNJSRD-UHFFFAOYAN;
(4) Std. InChI: InChI=1S/C14H10O2/c15-14(16)10-5-6-13-11(8-10)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H,15,16);
(5) Std. InChIKey: IBIDFEWDKNJSRD-UHFFFAOYSA-N