Cas no 62736-80-5 (Acetonitrile, [(2-methylpropyl)nitrosoamino]-)
![Acetonitrile, [(2-methylpropyl)nitrosoamino]- structure](https://ossimg.kuujia.com/scimg/63000/62736-80-5x500.png)
62736-80-5 structure
Product Name:Acetonitrile, [(2-methylpropyl)nitrosoamino]-
CAS No:62736-80-5
MF:C6H11N3O
MW:141.171040773392
CID:433652
PubChem ID:71383328
Update Time:2025-04-19
Acetonitrile, [(2-methylpropyl)nitrosoamino]- Chemical and Physical Properties
Names and Identifiers
-
- Acetonitrile, [(2-methylpropyl)nitrosoamino]-
- N-(cyanomethyl)-N-(2-methylpropyl)nitrous amide
- 62736-80-5
- DTXSID10805649
-
- Inchi： 1S/C6H11N3O/c1-6(2)5-9(8-10)4-3-7/h6H,4-5H2,1-2H3
- InChI Key： VKNXSNKAJLSJGI-UHFFFAOYSA-N
- SMILES： O=NN(CC#N)CC(C)C
Computed Properties
- Exact Mass: 141.09033
- Monoisotopic Mass: 141.090211983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 146
- 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: 1.3
- Topological Polar Surface Area: 56.5?2
Experimental Properties
- PSA: 56.46
Acetonitrile, [(2-methylpropyl)nitrosoamino]- Related Literature
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
62736-80-5 (Acetonitrile, [(2-methylpropyl)nitrosoamino]-) Related Products
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