Cas no 821776-74-3 (Benzenamine, N-(2-methoxyethyl)-3-methyl-4-nitro-N-propyl-)
821776-74-3 structure
Product Name:Benzenamine, N-(2-methoxyethyl)-3-methyl-4-nitro-N-propyl-
CAS No:821776-74-3
MF:C13H20N2O3
MW:252.309503555298
CID:697301
PubChem ID:11345762
Update Time:2025-04-19
Benzenamine, N-(2-methoxyethyl)-3-methyl-4-nitro-N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, N-(2-methoxyethyl)-3-methyl-4-nitro-N-propyl-
- N-(2-methoxyethyl)-3-methyl-4-nitro-N-propylaniline
- N-(2-methoxyethyl)-3-methyl-4-nitro-N-propylbenzenamine
- 821776-74-3
- SCHEMBL3051207
- DTXSID80463073
- FT-0727724
-
- Inchi： 1S/C13H20N2O3/c1-4-7-14(8-9-18-3)12-5-6-13(15(16)17)11(2)10-12/h5-6,10H,4,7-9H2,1-3H3
- InChI Key： OIYQDOPRPJDYNJ-UHFFFAOYSA-N
- SMILES： O(C)CCN(C1C=CC(=C(C)C=1)[N+](=O)[O-])CCC
Computed Properties
- Exact Mass: 252.14739250g/mol
- Monoisotopic Mass: 252.14739250g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 255
- 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: 3
- Topological Polar Surface Area: 58.3?2
Benzenamine, N-(2-methoxyethyl)-3-methyl-4-nitro-N-propyl- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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