Cas no 331256-17-8 ((4-bromophenyl)(2-methyl-1-piperidinyl)methanone)
331256-17-8 structure
Product Name:(4-bromophenyl)(2-methyl-1-piperidinyl)methanone
CAS No:331256-17-8
MF:C13H16BrNO
MW:282.176242828369
CID:1455298
PubChem ID:2839181
Update Time:2025-04-20
(4-bromophenyl)(2-methyl-1-piperidinyl)methanone Chemical and Physical Properties
Names and Identifiers
-
- (4-Bromophenyl)(2-methyl-1-piperidinyl)methanone
- (4-bromophenyl)(2-methylpiperidin-1-yl)methanone
- 1-((4-bromofuran-2-yl)methyl)-4-methylpiperazine
- SureCN2937177
- 1-[(4-bromo-furan-2-yl)methyl]-4-methylpiperazine
- CTK3D0142
- 2-(4-methylpiperazin-1-yl)-methyl-4-bromofuran
- 1-[(4-bromophenyl)carbonyl]-2-methylpiperidine
- Piperazine, 1-[(4-bromo-2-furanyl)methyl]-4-methyl-
- 1-[(4-bromo-2-furyl)methyl]-4-methylpiperazine
- DB-214881
- TimTec1_001450
- STK417237
- SR-01000203075-1
- AKOS016609348
- SCHEMBL788241
- NCGC00174418-01
- starbld0005451
- (4-bromophenyl)-(2-methylpiperidin-1-yl)methanone
- 1-(4-bromobenzoyl)-2-methylpiperidine
- AKOS000178494
- HMS1538B20
- SR-01000203075
- 331256-17-8
- AE-848/36304035
- (4-bromophenyl)(2-methyl-1-piperidinyl)methanone
-
- Inchi： 1S/C13H16BrNO/c1-10-4-2-3-9-15(10)13(16)11-5-7-12(14)8-6-11/h5-8,10H,2-4,9H2,1H3
- InChI Key： JONHPMAFVHSTQD-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)C(N1CCCCC1C)=O
Computed Properties
- Exact Mass: 281.04200
- Monoisotopic Mass: 281.04153g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 248
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31000
- LogP: 3.40160
(4-bromophenyl)(2-methyl-1-piperidinyl)methanone Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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