4, 6- Dihydroxy- 7- methoxycarbonylindan - CAS 114629-19-5
Catalog: |
BB068533 |
Product Name: |
4, 6- Dihydroxy- 7- methoxycarbonylindan |
CAS: |
114629-19-5 |
Synonyms: |
Methyl 5, 7- dihydroxy- 2, 3- dihydro- 1H- indene- 4- carboxylate;2, 3- Dihydro- 5, 7- dihydroxy-1H- Indene- 4- carboxylic Acid Methyl Ester |
IUPAC Name: | methyl 5,7-dihydroxy-2,3-dihydro-1H-indene-4-carboxylate |
Description: | 4, 6- Dihydroxy- 7- methoxycarbonylindan is a useful research chemical. |
Molecular Weight: | 208.21 |
Molecular Formula: | C11H12O4 |
Canonical SMILES: | COC(=O)C1=C(C=C(C2=C1CCC2)O)O |
InChI: | InChI=1S/C11H12O4/c1-15-11(14)10-7-4-2-3-6(7)8(12)5-9(10)13/h5,12-13H,2-4H2,1H3 |
InChI Key: | FSDUWZGNMBBQJW-UHFFFAOYSA-N |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.07355886 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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