Cas no 38439-92-8 ( )
structure
Product Name:
CAS No:38439-92-8
MF:C12H14O6
MW:254.235964298248
CID:923494
PubChem ID:297372
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 2-[4-(carboxymethyl)-2,5-dimethoxyphenyl]acetic acid
- (2,5-Dimethoxy-p-phenylen)-di-essigsaeure
- (2,5-dimethoxy-p-phenylene)-di-acetic acid
- 1,4-Bis-carboxymethyl-2,5-dimethoxy-benzol
- 2,5-Dimethoxy-1,4-phenylendiessigsaeure
- 2,5-Dimethoxy-p-benzoldiacetic Acid
- AC1L6RJ4
- NSC168501
- NSC-168501
- 2,2'-(2,5-Dimethoxy-1,4-phenylene)diacetic acid
- 38439-92-8
- SCHEMBL11420544
- DTXSID60304955
-
-
- Inchi： 1S/C12H14O6/c1-17-9-3-8(6-12(15)16)10(18-2)4-7(9)5-11(13)14/h3-4H,5-6H2,1-2H3,(H,13,14)(H,15,16)
- InChI Key： IQHJEHYXBKVYSN-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(CC(=O)O)C(=CC=1CC(=O)O)OC
Computed Properties
- Exact Mass: 254.07902
- Monoisotopic Mass: 254.07903816g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 273
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 93.1?2
Experimental Properties
- PSA: 93.06
- LogP: 0.95800
Related Literature
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Vanessa dos Santos Pereira Montera,Camila Aparecida Borges Food Funct., 2021,12, 7699-7708
-
Congyu Li,Wenfu Wang,Haiyan Wang,Guokai Yan,Weiyang Dong,Zhaosheng Chu,Huan Wang,Yang Chang RSC Adv., 2021,11, 26721-26731
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
38439-92-8 ( ) Related Products
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- 100861-38-9(3-Methoxy-4-methylphenylacetic Acid)
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