Cas no 55131-09-4 (Ethanol, 2-[(3-nitrophenyl)amino]-)
55131-09-4 structure
Product Name:Ethanol, 2-[(3-nitrophenyl)amino]-
CAS No:55131-09-4
MF:C8H10N2O3
MW:182.176601886749
CID:352751
PubChem ID:11644030
Update Time:2025-04-19
Ethanol, 2-[(3-nitrophenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol, 2-[(3-nitrophenyl)amino]-
- 2-(3-nitroanilino)ethanol
- HEHDBOAKGSCPGE-UHFFFAOYSA-N
- SCHEMBL3214047
- 55131-09-4
- 2-[(3-nitrophenyl)amino]-ethanol
- DTXSID70469908
- 2-(3-nitro-phenylamino)-ethanol
-
- Inchi: 1S/C8H10N2O3/c11-5-4-9-7-2-1-3-8(6-7)10(12)13/h1-3,6,9,11H,4-5H2
- InChI Key: HEHDBOAKGSCPGE-UHFFFAOYSA-N
- SMILES: OCCNC1C=CC=C(C=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 182.0692
- Monoisotopic Mass: 182.06914219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 169
- 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: 1.1
- Topological Polar Surface Area: 78.1?2
Experimental Properties
- PSA: 75.4
Ethanol, 2-[(3-nitrophenyl)amino]- 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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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