Cas no 6935-06-4 ((2,4,5-trichlorophenyl) N,N-dimethylcarbamate)
6935-06-4 structure
Product Name:(2,4,5-trichlorophenyl) N,N-dimethylcarbamate
CAS No:6935-06-4
MF:C9H8Cl3NO2
MW:268.524319648743
CID:525414
PubChem ID:226042
Update Time:2025-04-19
(2,4,5-trichlorophenyl) N,N-dimethylcarbamate Chemical and Physical Properties
Names and Identifiers
-
- (2,4,5-trichlorophenyl) N,N-dimethylcarbamate
- AR-1D2955; N,N-Dimethyl-carbaminsaeure-(2,4,5-trichlor-phenylester); AC1L5EH2; NSC16051; CTK2F8496; dimethyl-carbamic acid-(2,4,5-trichloro-phenyl ester); N,N-DIMETHYL-2,4,5-TRICHLOROPHENYL CARBAMATE; AC1Q3MMI; 2,4,5-Trichlorophenyl-N,N-dimethyl carbamate; Dimethyl-carbamidsaeure-(2,4,5-trichlor-phenylester);
- 2,4,5-Trichlorophenyl-N,N-dimethyl carbamate
- 2,4,5-TRICHLOROPHENYL DIMETHYLCARBAMATE
- NSC-16051
- 6935-06-4
- DTXSID90280238
- CHEMBL2288683
- NSC16051
-
- Inchi： 1S/C9H8Cl3NO2/c1-13(2)9(14)15-8-4-6(11)5(10)3-7(8)12/h3-4H,1-2H3
- InChI Key： VCSDFCWFZZFAEC-UHFFFAOYSA-N
- SMILES： ClC1C=C(C(=CC=1OC(N(C)C)=O)Cl)Cl
Computed Properties
- Exact Mass: 266.96224
- Monoisotopic Mass: 266.962062g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 237
- 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: 3.6
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
- LogP: 3.70720
(2,4,5-trichlorophenyl) N,N-dimethylcarbamate 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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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