Cas no 821777-14-4 (Benzenamine, N-(cyclopropylmethyl)-4-nitro-N-propyl-)
821777-14-4 structure
Product Name:Benzenamine, N-(cyclopropylmethyl)-4-nitro-N-propyl-
CAS No:821777-14-4
MF:C13H18N2O2
MW:234.294223308563
CID:697262
PubChem ID:69608757
Update Time:2025-04-19
Benzenamine, N-(cyclopropylmethyl)-4-nitro-N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, N-(cyclopropylmethyl)-4-nitro-N-propyl-
- N-(cyclopropylmethyl)-4-nitro-N-propylaniline
- N-(cyclopropylmethyl)-4-nitro-N-propylBenzenamine
- 821777-14-4
- DTXSID40740998
- FT-0709856
- SCHEMBL5923686
-
- Inchi： 1S/C13H18N2O2/c1-2-9-14(10-11-3-4-11)12-5-7-13(8-6-12)15(16)17/h5-8,11H,2-4,9-10H2,1H3
- InChI Key： UNFMGZKLECTAMI-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC(=CC=1)N(CCC)CC1CC1)=O
Computed Properties
- Exact Mass: 234.136827821g/mol
- Monoisotopic Mass: 234.136827821g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 253
- 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: 3.5
- Topological Polar Surface Area: 49.1?2
Benzenamine, N-(cyclopropylmethyl)-4-nitro-N-propyl- Related Literature
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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