Cas no 138745-88-7 (ethyl 4-(2-nitrophenylamino)benzoate)
138745-88-7 structure
Product Name:ethyl 4-(2-nitrophenylamino)benzoate
CAS No:138745-88-7
MF:C15H14N2O4
MW:286.282663822174
CID:2108900
PubChem ID:11208411
Update Time:2025-04-21
ethyl 4-(2-nitrophenylamino)benzoate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 4-(2-nitrophenylamino)benzoate
- ethyl 4-(2-nitroanilino)benzoate
- DTXSID20458847
- JSJMEIPLHVMQPA-UHFFFAOYSA-N
- Ethyl 4-[(2-nitrophenyl)amino]benzoate
- 138745-88-7
- SCHEMBL2258175
- DA-10880
-
- Inchi： 1S/C15H14N2O4/c1-2-21-15(18)11-7-9-12(10-8-11)16-13-5-3-4-6-14(13)17(19)20/h3-10,16H,2H2,1H3
- InChI Key： JSJMEIPLHVMQPA-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C=CC(=CC=1)NC1C=CC=CC=1[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 286.09535693Da
- Monoisotopic Mass: 286.09535693Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 361
- 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: 3.9
- Topological Polar Surface Area: 84.2?2
ethyl 4-(2-nitrophenylamino)benzoate Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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