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CAS No.: | 6838-85-3 |
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Name: | Lead phthalate |
Molecular Structure: | |
Formula: | C8H4O4Pb |
Molecular Weight: | 371.31 |
Synonyms: | 1,2-Benzenedicarboxylic acid, lead(2+) salt (1:1);Lead(2+) phthalate (1:1);1,2-Benzenedicarboxylic acid, lead(2+) salt (1:1); |
EINECS: | 229-927-0 |
Boiling Point: | 378.3 °C at 760 mmHg |
Flash Point: | 196.7 °C |
The IUPAC name of this chemical is lead(2+); phthalate. With the CAS registry number 6838-85-3 and EINECS 229-927-0, it is also named as Lead phthalate. In addition, the molecular formula is C8H4O4Pb and the molecular weight is 371.31. It belongs to the class of Organic-metal Salt.
Physical properties about Lead phthalate are: (1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.98; (4)ACD/LogD (pH 7.4): -3.3; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 74.6 Å2 ; (13)Flash Point: 196.7 °C; (14)Enthalpy of Vaporization: 66.05 kJ/mol; (15)Boiling Point: 378.3 °C at 760 mmHg; (16)Vapour Pressure: 2.14E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(c(c1)C(=O)[O-])C(=O)[O-].[Pb+2]
(2)InChI: InChI=1/C8H6O4.Pb/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2
(3)InChIKey: YJOMWQQKPKLUBO-NUQVWONBAR