Cas no 834-65-1 (1-(3-chlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine)
834-65-1 structure
Product Name:1-(3-chlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine
CAS No:834-65-1
MF:C9H11ClN2O3S
MW:262.713239908218
CID:1815357
PubChem ID:95971
Update Time:2025-04-21
1-(3-chlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine Chemical and Physical Properties
Names and Identifiers
-
- 1-(3-chlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine
- Oprea1_690892
- BRN 0554081
- Piperazine, 1-(3-chlorophenyl)-4-(1-naphthalenylmethyl)-
- Ambcb5269869
- AC1LG4ND
- N-(2-chloroethyl)-N-nitroso-p-toluenesulfonamide
- 1-(3-Chlorophenyl)-4-(1-naphthalenylmethyl)piperazine
- AC1Q3T37
- N-Nitroso-N-<
- 2-chlor-ethyl>
- -p-toluolsulfonamid
- -p-toluolsulfonsaeureamid
- CTK8D7426
- N-(2-Chloroethyl)-4-methyl-N-nitrosobenzene-1-sulfonamide
- N-(2-chloroethyl)-4-methyl-N-nitrosobenzenesulfonamide
- UNII-AS5JGM68EK
- p-Toluenesulphonamide, N-(2-chloroethyl)-N-nitroso-
- DTXSID201003390
- Benzenesulfonamide, N-(2-chloroethyl)-4-methyl-N-nitroso-
- N-(2-Chloroethyl)-N-nitroso-p-toluenesulphonamide
- NSC-45628
- CHEMBL354114
- p-Toluenesulfonamide, N-(2-chloroethyl)-N-nitroso-
- NSC45628
- Benzenesulphonamide, N-(2-chloroethyl)-4-methyl-N-nitroso-
- N-(2-Chloroethyl)-4-methyl-N-nitrosobenzenesulphonamide
- NSC 45628
- AS5JGM68EK
- 834-65-1
-
- Inchi: 1S/C9H11ClN2O3S/c1-8-2-4-9(5-3-8)16(14,15)12(11-13)7-6-10/h2-5H,6-7H2,1H3
- InChI Key: MXKIEKHOTITTDH-UHFFFAOYSA-N
- SMILES: ClCCN(N=O)S(C1C=CC(C)=CC=1)(=O)=O
Computed Properties
- Exact Mass: 262.0178911g/mol
- Monoisotopic Mass: 262.0178911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 320
- 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: 1.7
- Topological Polar Surface Area: 75.2?2
1-(3-chlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine Related Literature
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
-
5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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