Cas no 933740-47-7 (1H-Imidazole-5-aceticacid, 2,4-dimethyl-)
933740-47-7 structure
Product Name:1H-Imidazole-5-aceticacid, 2,4-dimethyl-
CAS No:933740-47-7
MF:C7H10N2O2
MW:154.166501522064
CID:802212
PubChem ID:22370326
Update Time:2025-04-19
1H-Imidazole-5-aceticacid, 2,4-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-5-acetic acid, 2,4-dimethyl-
- 2-(2,5-dimethyl-1H-imidazol-4-yl)acetic acid
- DTXSID10625243
- 933740-47-7
- 2-(2,4-Dimethyl-1H-imidazol-5-yl)acetic acid
- (2,5-Dimethyl-1H-imidazol-4-yl)acetic acid
- 1H-Imidazole-5-aceticacid, 2,4-dimethyl-
-
- Inchi: 1S/C7H10N2O2/c1-4-6(3-7(10)11)9-5(2)8-4/h3H2,1-2H3,(H,8,9)(H,10,11)
- InChI Key: QRWXWXAGUJBTAM-UHFFFAOYSA-N
- SMILES: OC(CC1=C(C)NC(C)=N1)=O
Computed Properties
- Exact Mass: 154.074227566g/mol
- Monoisotopic Mass: 154.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 161
- 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: 0.4
- Topological Polar Surface Area: 66?2
1H-Imidazole-5-aceticacid, 2,4-dimethyl- 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
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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