CAS No.53026-85-0,Aluminium, chloro hydroxy propylene glycol complexes Suppliers

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Basic Information

Molecular Structure:
CAS No.:	53026-85-0
Name:	Aluminium, chloro hydroxy propylene glycol complexes

Formula:	C₃H₁₀AlCl₃O₆
Molecular Weight:	275.4484
Synonyms:	Aluminumchlorhydrex;Rehydrol;Rehydrol II;
EINECS:	258-309-3
Boiling Point:	184.8 °C at 760 mmHg
Flash Point:	107.2 °C
PSA:	118.87000
LogP:	1.34480

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Specification

The Aluminum Chlorohydrex, with the CAS registry number 53026-85-0, is also known as Aluminum trihypochlorite - propane-1,2-diol (1:1) hydrate. It belongs to the product category of UVCBs-Organometallic. Its EINECS registry number is 258-309-3. This chemical's molecular formula is C₃H₁₀AlCl₃O₆ and molecular weight is 275.4484. What's more, its IUPAC name is called Aluminum propane-1,2-diol trihypochlorite hydrate. The classification codes are Anhidrotic and Astringent [topical].

Physical properties about Aluminum Chlorohydrex are: (1)ACD/LogP: -1.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.34; (4)ACD/LogD (pH 7.4): -1.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.44; (8)ACD/KOC (pH 7.4): 4.44; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 18.46 Å²; (13)Flash Point: 107.2 °C; (14)Enthalpy of Vaporization: 49.01 kJ/mol; (15)Boiling Point: 184.8 °C at 760 mmHg; (16)Vapour Pressure: 0.204 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [Al+3].Cl[O-].[O-]Cl.[O-]Cl.O.OCC(O)C
(2) InChI: InChI=1/C3H8O2.Al.3ClO.H2O/c1-3(5)2-4;;3*1-2;/h3-5H,2H2,1H3;;;;;1H2/q;+3;3*-1;
(3) InChIKey: YXZZLAMCXFHTTE-UHFFFAOYAG