Cas no 1761-55-3 (1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]-)
1761-55-3 structure
Product Name:1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]-
CAS No:1761-55-3
MF:C13H11NO3
MW:229.231343507767
CID:1368744
PubChem ID:135839390
Update Time:2025-04-20
1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]-
- 4-hydroxy-6-[(2-hydroxyanilino)methylidene]cyclohexa-2,4-dien-1-one
- 1761-55-3
- DTXSID50708549
- 2-[(E)-(2-hydroxyphenyl)iminomethyl]benzene-1,4-diol
- N-(2,5-dihydroxybenzylidene )-2-hydroxyaniline
- SCHEMBL11410827
- 1,4-Benzenediol, 2-(2-hydroxyphenyl) iminomethyl-
- (E)-4-Hydroxy-2-[(2-hydroxyphenyl)iminiomethyl]phenolate
-
- Inchi: 1S/C13H11NO3/c15-10-5-6-12(16)9(7-10)8-14-11-3-1-2-4-13(11)17/h1-8,15-17H/b14-8+
- InChI Key: LHPMHOPCJIOVEM-RIYZIHGNSA-N
- SMILES: OC1C=CC(=CC=1/C=N/C1C=CC=CC=1O)O
Computed Properties
- Exact Mass: 229.074
- Monoisotopic Mass: 229.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 396
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 69.6A^2
- XLogP3: 2.2
1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
1761-55-3 (1,4-Benzenediol, 2-[[(2-hydroxyphenyl)imino]methyl]-) Related Products
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