Cas no 85079-45-4 (4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl-)
![4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl- structure](https://ossimg.kuujia.com/scimg/85500/85079-45-4x500.png)
85079-45-4 structure
Product Name:4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl-
CAS No:85079-45-4
MF:C14H13BrN4O
MW:333.183221578598
CID:730466
PubChem ID:135433933
Update Time:2025-04-19
4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl-
- (5Z)-5-[(6-bromo-1H-indol-3-yl)methylidene]-2-imino-1,3-dimethylimidazolidin-4-one
- 4-Imidazolidinone, 5-((6-bromo-1H-indol-3-yl)methylene)-2-imino-1,3-dimethyl-
- 85079-45-4
- CHEMBL463249
- PD182863
- BDBM50250840
- 6-bromoaplysinopsin
- 5-(6-Bromo-1H-indol-3-ylmethylene)-2-imino-1,3-dimethyl-imidazolidin-4-one
-
- Inchi： 1S/C14H13BrN4O/c1-18-12(13(20)19(2)14(18)16)5-8-7-17-11-6-9(15)3-4-10(8)11/h3-7,16,20H,1-2H3/b8-5+,16-14-
- InChI Key： RZEXTWCYINCKES-DQUZRBTMSA-N
- SMILES： BrC1C=CC2=C(C=1)N=C/C/2=C\C1=C(N(C)/C(=N\[H])/N1C)O
Computed Properties
- Exact Mass: 332.027274
- Monoisotopic Mass: 332.027274
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 478
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.2
- XLogP3: 1.4
Experimental Properties
- Density: 1.63
- Boiling Point: 471.2°C at 760 mmHg
- Flash Point: 238.8°C
- Refractive Index: 1.718
4-Imidazolidinone,5-[(6-bromo-1H-indol-3-yl)methylene]-2-imino-1,3-dimethyl- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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