2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol - CAS 2006278-33-5
Catalog: |
BB015615 |
Product Name: |
2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol |
CAS: |
2006278-33-5 |
Synonyms: |
2-(6-methoxy-2-naphthalenyl)-4-pentyn-2-ol; 2-(6-methoxynaphthalen-2-yl)pent-4-yn-2-ol |
IUPAC Name: | 2-(6-methoxynaphthalen-2-yl)pent-4-yn-2-ol |
Description: | 2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol (CAS# 2006278-33-5 ) is a useful research chemical. |
Molecular Weight: | 240.30 |
Molecular Formula: | C16H16O2 |
Canonical SMILES: | CC(CC#C)(C1=CC2=C(C=C1)C=C(C=C2)OC)O |
InChI: | InChI=1S/C16H16O2/c1-4-9-16(2,17)14-7-5-13-11-15(18-3)8-6-12(13)10-14/h1,5-8,10-11,17H,9H2,2-3H3 |
InChI Key: | QVJUKMATJCLHRK-UHFFFAOYSA-N |
LogP: | 3.07920 |
Complexity: | 329 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.115029749 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.115029749 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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