Cas no 75998-57-1 (Acetic acid,2-chloro-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-, methyl ester)
75998-57-1 structure
Product Name:Acetic acid,2-chloro-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-, methyl ester
CAS No:75998-57-1
MF:C9H7Cl3N2O2
MW:281.523079156876
CID:576702
PubChem ID:9577229
Update Time:2025-04-19
Acetic acid,2-chloro-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- Acetic acid,2-chloro-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-, methyl ester
- LogP
- methyl (2Z)-2-chloro-2-[(3,4-dichlorophenyl)hydrazinylidene]acetate
- 75998-57-1
- Acetic acid, chloro((3,4-dichlorophenyl)hydrazono)-, methyl ester
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- Inchi: 1S/C9H7Cl3N2O2/c1-16-9(15)8(12)14-13-5-2-3-6(10)7(11)4-5/h2-4,13H,1H3/b14-8-
- InChI Key: BUQRYEJRVBNULM-ZSOIEALJSA-N
- SMILES: ClC1=C(C=CC(=C1)N/N=C(/C(=O)OC)\Cl)Cl
Computed Properties
- Exact Mass: 279.957311
- Monoisotopic Mass: 279.957311
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 286
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.9
- Topological Polar Surface Area: 50.7
Experimental Properties
- Density: 1.487
- Boiling Point: 349.832°C at 760 mmHg
- Flash Point: 165.373°C
- Refractive Index: 1.585
Acetic acid,2-chloro-2-[2-(3,4-dichlorophenyl)hydrazinylidene]-, methyl ester Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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