METHYL 5-HYDROXY-1-NAPHTHOATE - CAS 91307-40-3
Catalog: |
BB043162 |
Product Name: |
METHYL 5-HYDROXY-1-NAPHTHOATE |
CAS: |
91307-40-3 |
Synonyms: |
1-Naphthalenecarboxylicacid, 5-hydroxy-, methyl ester; AK-78937 |
IUPAC Name: | methyl 5-hydroxynaphthalene-1-carboxylate |
Description: | METHYL 5-HYDROXY-1-NAPHTHOATE (CAS# 91307-40-3 ) is a useful research chemical. |
Molecular Weight: | 202.21 |
Molecular Formula: | C12H10O3 |
Canonical SMILES: | COC(=O)C1=CC=CC2=C1C=CC=C2O |
InChI: | InChI=1S/C12H10O3/c1-15-12(14)10-6-2-5-9-8(10)4-3-7-11(9)13/h2-7,13H,1H3 |
InChI Key: | JXPWWZATUWESQH-UHFFFAOYSA-N |
Purity: | 95 % |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.062994177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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