Cas no 252210-01-8 (dimethyl 5-(chloromethyl)isophthalate)
252210-01-8 structure
Product Name:dimethyl 5-(chloromethyl)isophthalate
CAS No:252210-01-8
MF:C11H11ClO4
MW:242.655642747879
CID:2146218
PubChem ID:45108192
Update Time:2025-04-21
dimethyl 5-(chloromethyl)isophthalate Chemical and Physical Properties
Names and Identifiers
-
- dimethyl 5-(chloromethyl)isophthalate
- dimethyl 5-(chloromethyl)benzene-1,3-dicarboxylate
- Dimethyl5-Chloromethyl-1,3-Benzene-Dicarboxylate
- 1,3-Benzenedicarboxylic acid, 5-(chloromethyl)-, 1,3-dimethyl ester
- AB70733
- SCHEMBL762808
- AKOS015890456
- 1,3-dimethyl 5-(chloromethyl)benzene-1,3-dicarboxylate
- DB-307841
- 252210-01-8
-
- Inchi： 1S/C11H11ClO4/c1-15-10(13)8-3-7(6-12)4-9(5-8)11(14)16-2/h3-5H,6H2,1-2H3
- InChI Key： IYYKJOHNIKKVAI-UHFFFAOYSA-N
- SMILES： ClCC1C=C(C(=O)OC)C=C(C(=O)OC)C=1
Computed Properties
- Exact Mass: 242.0345865Da
- Monoisotopic Mass: 242.0345865Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 243
- 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: 2
- Topological Polar Surface Area: 52.6?2
dimethyl 5-(chloromethyl)isophthalate Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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