Cas no 73533-00-3 (Ethanol,2-[(2-amino-4-benzothiazolyl)oxy]-)
73533-00-3 structure
Product Name:Ethanol,2-[(2-amino-4-benzothiazolyl)oxy]-
CAS No:73533-00-3
MF:C9H10N2O2S
MW:210.252900600433
CID:552800
PubChem ID:12538889
Update Time:2025-04-19
Ethanol,2-[(2-amino-4-benzothiazolyl)oxy]- Chemical and Physical Properties
Names and Identifiers
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- Ethanol,2-[(2-amino-4-benzothiazolyl)oxy]-
- Ethanol, 2-[(2-amino-4-benzothiazolyl)oxy]- (9CI)
- 2-[(2-amino-1,3-benzothiazol-4-yl)oxy]ethanol
- 2-[(2-Amino-1,3-benzothiazol-4-yl)oxy]ethan-1-ol
- 73533-00-3
- DTXSID90501753
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- Inchi: 1S/C9H10N2O2S/c10-9-11-8-6(13-5-4-12)2-1-3-7(8)14-9/h1-3,12H,4-5H2,(H2,10,11)
- InChI Key: DMOZSOOAODRJTE-UHFFFAOYSA-N
- SMILES: S1C(N)=NC2=C1C=CC=C2OCCO
Computed Properties
- Exact Mass: 210.04629874g/mol
- Monoisotopic Mass: 210.04629874g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 194
- 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: 1.3
- Topological Polar Surface Area: 96.6?2
Ethanol,2-[(2-amino-4-benzothiazolyl)oxy]- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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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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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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