Cas no 346720-48-7 ((4-bromophenyl)(3-methyl-1-piperidinyl)methanone)
346720-48-7 structure
Product Name:(4-bromophenyl)(3-methyl-1-piperidinyl)methanone
CAS No:346720-48-7
MF:C13H16BrNO
MW:282.176242828369
CID:1464111
PubChem ID:2843153
Update Time:2025-04-20
(4-bromophenyl)(3-methyl-1-piperidinyl)methanone Chemical and Physical Properties
Names and Identifiers
-
- (4-Bromophenyl)(3-methyl-1-piperidinyl)methanone
- SR-01000206561-1
- (4-bromophenyl)(3-methylpiperidin-1-yl)methanone
- AK-968/11369133
- STK064979
- AKOS000195440
- SR-01000206561
- (4-bromophenyl)-(3-methylpiperidin-1-yl)methanone
- AKOS016072151
- starbld0026511
- 346720-48-7
- 1-(4-bromobenzoyl)-3-methylpiperidine
- (4-bromophenyl)(3-methyl-1-piperidinyl)methanone
-
- Inchi： 1S/C13H16BrNO/c1-10-3-2-8-15(9-10)13(16)11-4-6-12(14)7-5-11/h4-7,10H,2-3,8-9H2,1H3
- InChI Key： MMTVHKFZDQIJGM-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)C(N1CCCC(C)C1)=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: 3.25910
(4-bromophenyl)(3-methyl-1-piperidinyl)methanone Related Literature
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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