Cas no 40619-38-3 (Pyran, 4-bromo-3-propyltetrahydro)
40619-38-3 structure
Product Name:Pyran, 4-bromo-3-propyltetrahydro
CAS No:40619-38-3
MF:C8H15BrO
MW:207.108102083206
CID:2633258
PubChem ID:142477
Update Time:2025-04-21
Pyran, 4-bromo-3-propyltetrahydro Chemical and Physical Properties
Names and Identifiers
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- DTXSID20961028
- 40619-38-3
- 4-bromo-3-propyloxane
- 2H-Pyran, 4-bromotetrahydro-3-propyl-
- Pyran, 4-bromo-3-propyltetrahydro
-
- Inchi： 1S/C8H15BrO/c1-2-3-7-6-10-5-4-8(7)9/h7-8H,2-6H2,1H3
- InChI Key： SKPUCTHJZDZNKM-UHFFFAOYSA-N
- SMILES： BrC1CCOCC1CCC
Computed Properties
- Exact Mass: 206.03063g/mol
- Monoisotopic Mass: 206.03063g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 95.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 9.2?2
Pyran, 4-bromo-3-propyltetrahydro Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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