2-Methoxypentanoic Acid - CAS 66018-26-6
Catalog: |
BB032879 |
Product Name: |
2-Methoxypentanoic Acid |
CAS: |
66018-26-6 |
Synonyms: |
2-methoxypentanoic acid; 2-methoxypentanoic acid |
IUPAC Name: | 2-methoxypentanoic acid |
Description: | 2-Methoxypentanoic Acid (CAS# 66018-26-6 ) is a useful research chemical. |
Molecular Weight: | 132.16 |
Molecular Formula: | C6H12O3 |
Canonical SMILES: | CCCC(C(=O)O)OC |
InChI: | InChI=1S/C6H12O3/c1-3-4-5(9-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8) |
InChI Key: | ZWKQYTCYQWWVQJ-UHFFFAOYSA-N |
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Complexity: | 90.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 132.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 132.078644241 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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