1,3-Naphthalenediol - CAS 132-86-5
Catalog: |
BB043948 |
Product Name: |
1,3-Naphthalenediol |
CAS: |
132-86-5 |
Synonyms: |
3-Hydroxybenzocyclohexadien-1-one; 1,3-Dihydroxynaphthalene; NSC 115890; Naphthoresorcinol |
IUPAC Name: | naphthalene-1,3-diol |
Description: | 1,3-Naphthalenediol (CAS# 132-86-5 ) is a useful research chemical. |
Molecular Weight: | 160.17 |
Molecular Formula: | C10H8O2 |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(C=C2O)O |
InChI: | InChI=1S/C10H8O2/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,11-12H |
InChI Key: | XOOMNEFVDUTJPP-UHFFFAOYSA-N |
Boiling Point: | 361.5 °C at 760 mmHg |
Melting Point: | 123-126 °C |
Purity: | 99 % |
Density: | 1.33 g/cm3 |
Solubility: | Soluble in Acetonitrile (Slightly), DMSO (Slightly) |
Appearance: | Orange-pink to brown crystalline powder |
Vapor Pressure: | 0.00000715 [mmHg] |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.052429494 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 40.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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