Cas no 39087-48-4 (Propanoic acid,2-(4-chlorophenoxy)-2-methyl-, calcium salt (2:1))
39087-48-4 structure
Product Name:Propanoic acid,2-(4-chlorophenoxy)-2-methyl-, calcium salt (2:1)
CAS No:39087-48-4
MF:C20H20CaCl2O6
MW:467.353203773499
CID:308728
PubChem ID:68659
Update Time:2025-04-19
Propanoic acid,2-(4-chlorophenoxy)-2-methyl-, calcium salt (2:1) Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,2-(4-chlorophenoxy)-2-methyl-, calcium salt (2:1)
- calcium,2-(4-chlorophenoxy)-2-methylpropanoate
- AC1L2A6J
- Calcii clofibras
- Calcii clofibras [INN-Latin]
- Calcium Clofibrate
- CHEMBL2106625
- Clofibrate de calcium
- Clofibrato calcico
- UNII-TT85QFR500
- Calcium Clofibrate [INN]
- 39087-48-4
- DTXSID60959904
- Calcium 2-(p-chlorophenoxy)-2-methylpropionate
- TT85QFR500
- Clofibrato calcico [INN-Spanish]
- Q27290309
- Clofibrate de calcium [INN-French]
- EINECS 254-284-8
- SCHEMBL11798230
- calcium bis[2-(4-chlorophenoxy)-2-methylpropanoate]
- CALCIUM CLOFIBRATE [MART.]
-
- Inchi： 1S/2C10H11ClO3.Ca/c2*1-10(2,9(12)13)14-8-5-3-7(11)4-6-8;/h2*3-6H,1-2H3,(H,12,13);/q;;+2/p-2
- InChI Key： IXCILCKRXAZYGP-UHFFFAOYSA-L
- SMILES： [Ca+2].ClC1C=CC(=CC=1)OC(C(=O)[O-])(C)C.ClC1C=CC(=CC=1)OC(C(=O)[O-])(C)C
Computed Properties
- Exact Mass: 466.0262846g/mol
- Monoisotopic Mass: 466.0262846g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 29
- Rotatable Bond Count: 4
- Complexity: 202
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 98.7?2
Propanoic acid,2-(4-chlorophenoxy)-2-methyl-, calcium salt (2:1) Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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