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CAS No.: | 65269-84-3 |
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Name: | chloroacetic acid - trimethylplumbanyl (1:1) |
Molecular Structure: | |
Formula: | C5H12ClO2Pb |
Molecular Weight: | 346.8006 |
Synonyms: | Chloroacetic acid - trimethylplumbanyl (1:1); |
Boiling Point: | 189 °C at 760 mmHg |
Flash Point: | 71.5 °C |
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The 2-Chloroacetic acid; trimethyllead has CAS registry number 65269-84-3. This chemical's molecular formula is C5H12ClO2Pb and molecular weight is 346.8006. What's more, its systematic name is Chloroacetic acid - trimethylplumbanyl (1:1).
Physical properties about 2-Chloroacetic acid; trimethyllead are: (1)ACD/LogP: -0.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.85; (4)ACD/LogD (pH 7.4): -3.76; (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: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å2; (13)Flash Point: 71.5 °C; (14)Enthalpy of Vaporization: 46.87 kJ/mol; (15)Boiling Point: 189 °C at 760 mmHg; (16)Vapour Pressure: 0.259 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C[Pb](C)C.C(C(=O)O)Cl
(2) InChI: InChI=1/C2H3ClO2.3CH3.Pb/c3-1-2(4)5;;;;/h1H2,(H,4,5);3*1H3;/rC3H9Pb.C2H3ClO2/c1-4(2)3;3-1-2(4)5/h1-3H3;1H2,(H,4,5)
(3) InChIKey: POLPZYRSFOZMLE-IHDLTTJYAF