Cas no 130787-81-4 (1-Butanamine,N,2-dimethyl-N-nitroso-)
130787-81-4 structure
Product Name:1-Butanamine,N,2-dimethyl-N-nitroso-
CAS No:130787-81-4
MF:C6H14N2O
MW:130.188161373138
CID:198328
PubChem ID:3035588
Update Time:2025-04-19
1-Butanamine,N,2-dimethyl-N-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butanamine,N,2-dimethyl-N-nitroso-
- N-methyl-N-(2-methylbutyl)nitrous amide
- N-nitrosomethyl(2-methylbutyl)amine
- N,2-dimethyl-N-nitrosobutan-1-amine
- NM2MBA
- DTXSID50926908
- 1-Butanamine, N,2-dimethyl-N-nitroso-
- 130787-81-4
-
- Inchi： 1S/C6H14N2O/c1-4-6(2)5-8(3)7-9/h6H,4-5H2,1-3H3
- InChI Key： RAPPKPUENZGVFU-UHFFFAOYSA-N
- SMILES： O=NN(C)CC(C)CC
Computed Properties
- Exact Mass: 130.11072
- Monoisotopic Mass: 130.110613
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 85.1
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.7
- XLogP3: 1.9
Experimental Properties
- Density: 0.93
- Boiling Point: 205.5°Cat760mmHg
- Flash Point: 78.1°C
- Refractive Index: 1.451
- PSA: 32.67
1-Butanamine,N,2-dimethyl-N-nitroso- Related Literature
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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