Cas no 101055-82-7 (1,4-Methanopentalene-3-carbonyl chloride, octahydro- (9CI))
101055-82-7 structure
Product Name:1,4-Methanopentalene-3-carbonyl chloride, octahydro- (9CI)
CAS No:101055-82-7
MF:C10H13ClO
MW:184.662622213364
CID:124453
PubChem ID:45081562
Update Time:2025-04-18
1,4-Methanopentalene-3-carbonyl chloride, octahydro- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Methanopentalene-3-carbonyl chloride, octahydro- (9CI)
- 1,4-Methanopentalene-3-carbonylchloride, octahydro-
- 4-Chlortricyclo[4.3.0.03,7]nonan
- 4-Chlortricyclo< 4.3.0.03,7> nonan
- ACMC-20m443
- AG-D-07320
- CTK0H2375
- DTXSID90664690
- Octahydro-1,4-methanopentalene-3-carbonyl chloride
- 101055-82-7
-
- Inchi： 1S/C10H13ClO/c11-10(12)8-4-6-3-5-1-2-7(6)9(5)8/h5-9H,1-4H2
- InChI Key： SSMXNVUDRZXXDR-UHFFFAOYSA-N
- SMILES： ClC(C1CC2CC3CCC2C31)=O
Computed Properties
- Exact Mass: 184.06559
- Monoisotopic Mass: 184.065
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 238
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 17.1A^2
- XLogP3: 3.1
Experimental Properties
- PSA: 17.07
1,4-Methanopentalene-3-carbonyl chloride, octahydro- (9CI) Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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