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19800-49-8

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Basic Information
CAS No.: 19800-49-8
Name: Naphthalene-2,7-dicarboxaldehyde
Article Data: 7
Molecular Structure:
Molecular Structure of 19800-49-8 (Naphthalene-2,7-dicarboxaldehyde)
Formula: C12H8O2
Molecular Weight: 184.19
Synonyms: Naphthalene-2,7-dicarbaldehyde;Naphthalene-2,7-dicarboxaldehyde;
Density: 1.254 g/cm3
Boiling Point: 373.585 °C at 760 mmHg
Flash Point: 140.14 °C
PSA: 34.14000
LogP: 2.46480
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Specification

The 2,7-Naphthalenedicarboxaldehyde, with the CAS registry number 19800-49-8, is also known as Naphthalene-2,7-dicarboxaldehyde. This chemical's molecular formula is C12H8O2 and molecular weight is 184.19. What's more, its systematic name is naphthalene-2,7-dicarbaldehyde.

Physical properties of 2,7-Naphthalenedicarboxaldehyde are: (1)ACD/LogP: 1.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 33; (6)ACD/BCF (pH 7.4): 33; (7)ACD/KOC (pH 5.5): 421; (8)CD/KOC (pH 7.4): 421; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 34.14 Å2; (13)Index of Refraction: 1.713; (14)Molar Refractivity: 57.601 cm3; (15)Molar Volume: 146.881 cm3; (16)Polarizability: 22.835×10-24cm3; (17)Surface Tension: 55.677 dyne/cm; (18)Density: 1.254 g/cm3; (19)Flash Point: 140.14 °C; (20)Enthalpy of Vaporization: 62.087 kJ/mol; (21)Boiling Point: 373.585 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc2cc(ccc2cc1)C=O
(2)InChI: InChI=1S/C12H8O2/c13-7-9-1-3-11-4-2-10(8-14)6-12(11)5-9/h1-8H
(3)InChIKey: WSPGRORDDACGQK-UHFFFAOYSA-N