Cas no 91006-31-4 (n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine)
91006-31-4 structure
Product Name:n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine
CAS No:91006-31-4
MF:C10H16N4O2
MW:224.259641647339
CID:995436
PubChem ID:3021745
Update Time:2025-04-20
n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine Chemical and Physical Properties
Names and Identifiers
-
- n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine
- N',N'-dimethyl-N-(5-nitropyridin-2-yl)propane-1,3-diamine
- EINECS 292-912-2
- AKOS008994819
- NS00039383
- 91006-31-4
- SCHEMBL9794274
- DTXSID40238365
- HKHGKYUDPOLSFT-UHFFFAOYSA-N
-
- Inchi： 1S/C10H16N4O2/c1-13(2)7-3-6-11-10-5-4-9(8-12-10)14(15)16/h4-5,8H,3,6-7H2,1-2H3,(H,11,12)
- InChI Key： HKHGKYUDPOLSFT-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CN=C(C=C1)NCCCN(C)C)=O
Computed Properties
- Exact Mass: 224.12732577g/mol
- Monoisotopic Mass: 224.12732577g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 217
- 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: 1.4
- Topological Polar Surface Area: 74?2
n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
91006-31-4 (n,n-dimethyl-n'-(5-nitro-2-pyridyl)propane-1,3-diamine) Related Products
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