Cas no 35059-06-4 (2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1))
![2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1) structure](https://ossimg.kuujia.com/scimg/35500/35059-06-4x500.png)
35059-06-4 structure
Product Name:2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1)
CAS No:35059-06-4
MF:C11H18Cl2N2O
MW:265.179420948029
CID:306240
PubChem ID:169657
Update Time:2025-04-19
2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1)
- 1-(4-((2-Chloroethyl)methylamino)-2-butynyl)-2-pyrrolidinone hydrochloride
- 2-Pyrrolidinone, 1-(4-((2-chloroethyl)methylamino)-2-butynyl)-, hydrochloride
- 2-Pyrrolidinone, 1-(4-((2-chloroethyl)methylamino)-2-butynyl)-, monohydrochloride
- 35059-06-4
- DTXSID00956497
- BM 123
- BM 123 hydrochloride
- NIOSH/UY5746600
- 1-{4-[(2-Chloroethyl)(methyl)amino]but-2-yn-1-yl}pyrrolidin-2-one--hydrogen chloride (1/1)
- N-(4-(2-Chloroethylmethylamino)-2-butynyl)-2-pyrrolidone
- Dso-16
- 1-(2-Oxo-1-pyrrolidino)-4-(2-chloroethylmethylamino)but-2-yne hydrochloride
- UY57466000
-
- Inchi： 1S/C11H17ClN2O.ClH/c1-13(10-6-12)7-2-3-8-14-9-4-5-11(14)15;/h4-10H2,1H3;1H
- InChI Key： IZGRDLKPFOIZGE-UHFFFAOYSA-N
- SMILES： ClCCN(C)CC#CCN1C(CCC1)=O.Cl
Computed Properties
- Exact Mass: 264.07984
- Monoisotopic Mass: 264.08
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 279
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 23.6?2
Experimental Properties
- Boiling Point: 346.8°Cat760mmHg
- Flash Point: 163.5°C
- PSA: 23.55
2-Pyrrolidinone,1-[4-[(2-chloroethyl)methylamino]-2-butyn-1-yl]-, hydrochloride (1:1) Related Literature
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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