Cas no 4991-68-8 ( )
structure
Product Name:
CAS No:4991-68-8
MF:C16H28Cl2N2
MW:319.312922477722
CID:932930
PubChem ID:20055541
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 4-Benzyl-1-[2-(dimethylamino)ethyl]piperidine dihydrochloride
- Pimetine hydrochloride
- IN-379
- NSC-528880
- Q27282874
- 1-Piperidineethanamine, N,N-dimethyl-4-(phenylmethyl)-, dihydrochloride
- 4991-68-8
- 4-Benzyl-1-(2-(dimethylamino)ethyl)piperidine dihydrochloride
- pimetinehydrochlorid
- IN 379
- Pimetine hydrochloride (USAN)
- NSC 528880
- UNII-L9C364S02D
- SCHEMBL636750
- Pimetine HCl
- D05481
- L9C364S02D
- Pimetine hydrochloride [USAN]
-
-
- Inchi： 1S/C16H26N2.2ClH/c1-17(2)12-13-18-10-8-16(9-11-18)14-15-6-4-3-5-7-15;;/h3-7,16H,8-14H2,1-2H3;2*1H
- InChI Key： XZRWNULNYWMWBM-UHFFFAOYSA-N
- SMILES： Cl.Cl.N1(CCN(C)C)CCC(CC2C=CC=CC=2)CC1
Computed Properties
- Exact Mass: 318.16324
- Monoisotopic Mass: 318.163
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 213
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 6.5A^2
Experimental Properties
- Boiling Point: 400.5°C at 760 mmHg
- Flash Point: 196°C
- PSA: 6.48
- LogP: 3.24260
Related Literature
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
4991-68-8 ( ) Related Products
- 25842-32-4(2-(4-Benzylpiperidin-1-yl)ethanamine)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
Recommended suppliers
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
