Cas no 166972-38-9 (Bicyclo[2.2.1]heptane-2-carbonylchloride, 2-methyl-)
166972-38-9 structure
Product Name:Bicyclo[2.2.1]heptane-2-carbonylchloride, 2-methyl-
CAS No:166972-38-9
MF:C9H13ClO
MW:172.651921987534
CID:110836
PubChem ID:12316763
Update Time:2025-04-18
Bicyclo[2.2.1]heptane-2-carbonylchloride, 2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2-carbonylchloride, 2-methyl-
- 3-methylbicyclo[2.2.1]heptane-3-carbonyl chloride
- Bicyclo[2.2.1]heptane-2-carbonyl chloride, 2-methyl- (9CI)
- 2-methylbicyclo[2.2.1]heptane-2-carbonyl chloride
- DTXSID50487761
- SCHEMBL5883622
- 166972-38-9
-
- Inchi: 1S/C9H13ClO/c1-9(8(10)11)5-6-2-3-7(9)4-6/h6-7H,2-5H2,1H3
- InChI Key: LCAKOBGONCQGOE-UHFFFAOYSA-N
- SMILES: ClC(C1(C)CC2CCC1C2)=O
Computed Properties
- Exact Mass: 172.06559
- Monoisotopic Mass: 172.0654927g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 202
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.1
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Bicyclo[2.2.1]heptane-2-carbonylchloride, 2-methyl- Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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