Butyl 6-hydroxyhexanoate - CAS 15545-98-9
Catalog: |
BB071752 |
Product Name: |
Butyl 6-hydroxyhexanoate |
CAS: |
15545-98-9 |
Synonyms: |
Butyl 6-hydroxycaproate; 1-Butyl ε-hydroxycaproate; 6-Hydroxy-hexanoic Acid Butyl Ester |
IUPAC Name: | butyl 6-hydroxyhexanoate |
Description: | Butyl 6-hydroxyhexanoate (cas# 15545-98-9) is a compound useful in organic synthesis. |
Molecular Weight: | 188.26 |
Molecular Formula: | C10H20O3 |
Canonical SMILES: | CCCCOC(=O)CCCCCO |
InChI: | InChI=1S/C10H20O3/c1-2-3-9-13-10(12)7-5-4-6-8-11/h11H,2-9H2,1H3 |
InChI Key: | CEQMDSFVFKDZCR-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Clear Colorless Oil |
Complexity: | 123 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.1412445 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.1412445 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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