2-(3-Methoxypropoxy)benzaldehyde - CAS 853643-70-6
Catalog: |
BB060071 |
Product Name: |
2-(3-Methoxypropoxy)benzaldehyde |
CAS: |
853643-70-6 |
Synonyms: |
2-(3-Methoxypropoxy)benzaldehyde; 2-(3-Methoxy-propoxy)-benzaldehyde |
IUPAC Name: | 2-(3-methoxypropoxy)benzaldehyde |
Description: | 2-(3-Methoxypropoxy)benzaldehyde |
Molecular Weight: | 194.23 |
Molecular Formula: | C11H14O3 |
Canonical SMILES: | COCCCOC1=CC=CC=C1C=O |
InChI: | InChI=1S/C11H14O3/c1-13-7-4-8-14-11-6-3-2-5-10(11)9-12/h2-3,5-6,9H,4,7-8H2,1H3 |
InChI Key: | PNJHBPLCUDFAQV-UHFFFAOYSA-N |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.094294304 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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