Cas no 84245-84-1 (4-Thiazoleacetic acid,2,2'-(carbonyldiimino)bis[a-(methoxyimino)-, dimethyl ester, (Z,Z)- (9CI))
84245-84-1 structure
Product Name:4-Thiazoleacetic acid,2,2'-(carbonyldiimino)bis[a-(methoxyimino)-, dimethyl ester, (Z,Z)- (9CI)
CAS No:84245-84-1
MF:C15H16N6O7S2
MW:456.453539848328
CID:731329
PubChem ID:9588604
Update Time:2025-04-19
4-Thiazoleacetic acid,2,2'-(carbonyldiimino)bis[a-(methoxyimino)-, dimethyl ester, (Z,Z)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- methyl (2Z)-2-methoxyimino-2-[2-[[4-[(Z)-N-methoxy-C-methoxycarbonylcarbonimidoyl]-1,3-thiazol-2-yl]carbamoylamino]-1,3-thiazol-4-yl]acetate
- 84245-84-1
- Dimethyl (Z,Z)-2,2'-(carboxyldiimino)bis(alpha-(methoxyimino)-4-thiazoleacetate)
- 4-Thiazoleacetic acid, 2,2'-(carboxyldiimino)bis(alpha-(methoxyimino)-, dimethyl ester, (Z,Z)-
- 4-Thiazoleacetic acid,2,2'-(carbonyldiimino)bis[a-(methoxyimino)-, dimethyl ester, (Z,Z)- (9CI)
-
- Inchi： 1S/C15H16N6O7S2/c1-25-11(22)9(20-27-3)7-5-29-14(16-7)18-13(24)19-15-17-8(6-30-15)10(21-28-4)12(23)26-2/h5-6H,1-4H3,(H2,16,17,18,19,24)/b20-9-,21-10-
- InChI Key： ODMJIQJYAXNIBW-UPVMUGGESA-N
- SMILES： S1C=C(/C(/C(=O)OC)=N/OC)N=C1NC(NC1=NC(/C(/C(=O)OC)=N/OC)=CS1)=O
Computed Properties
- Exact Mass: 456.052188
- Monoisotopic Mass: 456.052188
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 30
- Rotatable Bond Count: 10
- Complexity: 651
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 219
- XLogP3: 2.5
Experimental Properties
- Density: 1.58
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.671
4-Thiazoleacetic acid,2,2'-(carbonyldiimino)bis[a-(methoxyimino)-, dimethyl ester, (Z,Z)- (9CI) Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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