2- Chlorotetrahydro- 2H- pyran - CAS 3136-02-5
Catalog: |
BB069510 |
Product Name: |
2- Chlorotetrahydro- 2H- pyran |
CAS: |
3136-02-5 |
Synonyms: |
2-Chlorotetrahydropyran |
IUPAC Name: | 2-chlorooxane |
Description: | 2- Chlorotetrahydro- 2H- pyran is a commonly used starting material in organic synthesis. |
Molecular Weight: | 120.58 |
Molecular Formula: | C5H9ClO |
Canonical SMILES: | C1CCOC(C1)Cl |
InChI: | InChI=1S/C5H9ClO/c6-5-3-1-2-4-7-5/h5H,1-4H2 |
InChI Key: | QRECIVPUECYDDM-UHFFFAOYSA-N |
References: | Stapp, C.R., et al. J. Org. Chem., 36, 522-25 (1971). |
Complexity: | 56 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 120.0341926 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 120.0341926 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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