Cas no 1132-20-3 (Ethanone,1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloro-)
1132-20-3 structure
Product Name:Ethanone,1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloro-
CAS No:1132-20-3
MF:C10H16ClNO
MW:201.693141937256
CID:157253
PubChem ID:14331
Update Time:2025-04-19
Ethanone,1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloro-
- 1-(3-azabicyclo[3.2.2]nonan-3-yl)-2-chloroethanone
- 3-(Chloroacetyl)-3-azabicyclo[3.2.2]nonane
- 3-AZABICYCLO(3.2.2)NONANE, 3-(CHLOROACETYL)-
- 3-Azabicyclo[3.2.2]nonane, 3-(chloroacetyl)-
- 3-chloroacetyl-3-aza-bicyclo[3.2.2]nonane
- BRN 1682165
- Ketone, 3-azabicyclo(3.2.2)nonyl chloromethyl
- Ketone, 3-azabicyclo[3.2.2]nonyl chloromethyl
- N-(Chloroacetyl)-3-azabicyclo(3.2.1)nonane
- N-(Chloroacetyl)-3-azabicyclo[3.2.1]nonane
- N-Chloracetyl-3-azabicyclo< 3.2.2> nonan
- N-Chlormethylcarbonyl-3-azabicyclo< 3.2.2> nonan
- SureCN
- 1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloroethanone
- NSC-221302
- NSC221302
- SCHEMBL224873
- OZKJSYJSHRYFEH-UHFFFAOYSA-N
- DTXSID40150316
- 5-20-04-00381 (Beilstein Handbook Reference)
- 1132-20-3
- NSC 221302
- WLN: T67 A B HNTJ HV1G
-
- Inchi: 1S/C10H16ClNO/c11-5-10(13)12-6-8-1-2-9(7-12)4-3-8/h8-9H,1-7H2
- InChI Key: OZKJSYJSHRYFEH-UHFFFAOYSA-N
- SMILES: ClCC(N1CC2CCC(C1)CC2)=O
Computed Properties
- Exact Mass: 201.09218
- Monoisotopic Mass: 201.0920418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 185
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.8
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- Color/Form: Flammable liquid
- Density: 1.0787 (rough estimate)
- Refractive Index: 1.6000 (estimate)
- PSA: 20.31
Ethanone,1-(3-azabicyclo[3.2.2]non-3-yl)-2-chloro- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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