1,6-Dihydroxy Naphthalene
Product Information
Molecular Formula
C10H8O2
Molecular Weight
160.17
Description
Naphthalene-1,6-diol is a naphthalenediol.
Synonyms
1,6-NAPHTHALENEDIOL; 1,6-DIHYDROXYNAPHTHALENE; 2,5-DIHYDROXYNAPHTHALENE; 2,5-Naphthalenediol; 6-Hydroxy-1-naphthol; C.I. 76630
IUPAC Name
naphthalene-1,6-diol
SMILES
C1=CC2=C(C=CC(=C2)O)C(=C1)O
InChI
InChI=1S/C10H8O2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-6,11-12H
InChI Key
FZZQNEVOYIYFPF-UHFFFAOYSA-N
Boiling Point
375.4°C at 760 mmHg
Melting Point
130-133°C
Purity
98%
Density
1.33 g/cm3
Appearance
prisms
Storage
Keep away from heat, sparks, and flame.
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Computed Properties
XLogP3
1.9
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
0
Exact Mass
160.052429494 g/mol
Monoisotopic Mass
160.052429494 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
158
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022040214-A | Resin composition | 2022-01-05 |
| JP-2022028036-A | Dry films, cured products, and electronic components | 2021-12-21 |
| JP-2022031285-A | Resin composition, sheet-like laminated material, printed wiring board and semiconductor device | 2021-11-24 |
| CN-114011242-A | Carboxylated poly (arylene ether nitrile) ultrafiltration membrane and preparation method thereof | 2021-11-22 |
| JP-2022022261-A | Resin composition | 2021-11-22 |
| JP-2022027768-A | Resin composition | 2021-11-16 |
| CN-114163463-A | Near-infrared fluorescent two-photon fluorescent probe design aiming at real-time change of hydrogen peroxide in tumor process and synthetic method thereof | 2021-10-31 |
| CN-113929846-A | High-carbon-formation-rate water-soluble phenolic resin and preparation method thereof | 2021-10-22 |
| CN-113861383-A | Epoxy resin containing naphthalene ring structure and preparation method thereof | 2021-10-19 |
| JP-2022017350-A | Adhesive sheet with support | 2021-10-19 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 23016299 | 2012-06-01 | [Simultaneous determination of seven naphthalenediols in cosmetics by reversed-phase high performance liquid chromatography] | Se pu = Chinese journal of chromatography |
| 21217882 | 2010-09-01 | Various aspects of piscine toxicology | Interdisciplinary toxicology |
| 18682327 | 2008-09-01 | Chemoenzymatic syntheses of prenylated aromatic small molecules using Streptomyces prenyltransferases with relaxed substrate specificities | Bioorganic & medicinal chemistry |
| 17609576 | 2007-07-01 | Naphthalene-1,6-diol: a three-dimensional framework built from O-H...O, O-H...pi and C-H...O hydrogen bonds | Acta crystallographica. Section C, Crystal structure communications |
| 17260959 | 2007-02-06 | Understanding the substrate selectivity and the product regioselectivity of Orf2-catalyzed aromatic prenylations | Biochemistry |
| 16539380 | 2006-03-23 | Selective antiproliferative activity of hydroxynaphthyl-beta-D-xylosides | Journal of medicinal chemistry |
| 15959519 | 2005-06-16 | Structural basis for the promiscuous biosynthetic prenylation of aromatic natural products | Nature |
| 11677123 | 2001-11-19 | Synthesis and photophysical properties of new fluorinated benzo[c]xanthene dyes as intracellular pH indicators | Bioorganic & medicinal chemistry letters |
