Methyl 4-[[4-(Allyloxy)phenyl](hydroxy)methyl]tetrahydropyran-4-carboxylate - CAS 2006276-94-2
Catalog: |
BB015497 |
Product Name: |
Methyl 4-[[4-(Allyloxy)phenyl](hydroxy)methyl]tetrahydropyran-4-carboxylate |
CAS: |
2006276-94-2 |
Synonyms: |
4-[hydroxy-(4-prop-2-enoxyphenyl)methyl]-4-oxanecarboxylic acid methyl ester; methyl 4-[hydroxy-(4-prop-2-enoxyphenyl)methyl]oxane-4-carboxylate |
IUPAC Name: | methyl 4-[hydroxy-(4-prop-2-enoxyphenyl)methyl]oxane-4-carboxylate |
Description: | Methyl 4-[[4-(Allyloxy)phenyl](hydroxy)methyl]tetrahydropyran-4-carboxylate (CAS# 2006276-94-2 ) is a useful research chemical. |
Molecular Weight: | 306.35 |
Molecular Formula: | C17H22O5 |
Canonical SMILES: | COC(=O)C1(CCOCC1)C(C2=CC=C(C=C2)OCC=C)O |
InChI: | InChI=1S/C17H22O5/c1-3-10-22-14-6-4-13(5-7-14)15(18)17(16(19)20-2)8-11-21-12-9-17/h3-7,15,18H,1,8-12H2,2H3 |
InChI Key: | YMMRTPKYDHEJPF-UHFFFAOYSA-N |
Complexity: | 367 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 306.1467238 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.1467238 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 65 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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