Cas no 31166-18-4 (Aluminum,tris[(2,4-dichlorophenoxy)acetato-O1,O2]- (9CI))
31166-18-4 structure
Product Name:Aluminum,tris[(2,4-dichlorophenoxy)acetato-O1,O2]- (9CI)
CAS No:31166-18-4
MF:C24H15AlCl6O9
MW:687.070040941238
CID:308918
PubChem ID:134955
Update Time:2025-04-19
Aluminum,tris[(2,4-dichlorophenoxy)acetato-O1,O2]- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Aluminum,tris[(2,4-dichlorophenoxy)acetato-O1,O2]- (9CI)
- 2,4-Dichlorophenoxyacetic acide amine salt
- Aluminium tris(2,4-dichlorophenoxyacetate)
- aluminum tris[(2,4-dichlorophenoxy)acetate]
- EINECS 250-497-5
- 31166-18-4
- NS00083911
- Aluminum tris(2,4-dichlorophenoxyacetate)
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- Inchi: 1S/3C8H6Cl2O3.Al/c3*9-5-1-2-7(6(10)3-5)13-4-8(11)12;/h3*1-3H,4H2,(H,11,12);/q;;;+3/p-3
- InChI Key: TZTFXNGHLVIMAM-UHFFFAOYSA-K
- SMILES: ClC1C=C(C=CC=1OCC(=O)[O-])Cl.ClC1C=C(C=CC=1OCC(=O)[O-])Cl.ClC1C=C(C=CC=1OCC(=O)[O-])Cl.[Al+3]
Computed Properties
- Exact Mass: 683.86645
- Monoisotopic Mass: 683.866262g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 40
- Rotatable Bond Count: 6
- Complexity: 181
- Covalently-Bonded Unit Count: 4
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 148?2
Experimental Properties
- PSA: 148.08
Aluminum,tris[(2,4-dichlorophenoxy)acetato-O1,O2]- (9CI) Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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