4-Methyl-1-naphthol

HCID 82483

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 10240-08-1
Standard SMILES: Cc1ccc(O)c2ccccc12
InChIKey: ZSUDUDXOEGHEJR-UHFFFAOYSA-N
Molecular formula: C11H10O
Average molar mass: 158.2 g/mol
Monoisotopic mass: 158.07316494

Names & identifiers

Preferred name: 4-Methyl-1-naphthol
IUPAC: 4-methylnaphthalen-1-ol
English name: 4-METHYL-1-NAPHTHOL
Molecular formula: C11H10O
Molecular weight: 158.2

Names & synonyms

4-Methyl-1-naphthol10240-08-11-Naphthalenol, 4-methyl-1-Naphthol, 4-methyl-EINECS 233-573-2DTXSID601450421-Naphthalenol, 4-ethyl-RefChem:99705DTXCID2067533233-573-2ZSUDUDXOEGHEJR-UHFFFAOYSA-N4-methylnaphthalen-1-ol

Show more names

4-Methyl-1-napthtalenol4-Methylnaphthalene-1-ol

MFCD000603444-methyl-naphtholBS-14223CS-0444441EN300-243455W185754-Methyl-1-naphthalenolFT-0692533

Database identifiers

CAS: 10240-08-1
PubChem CID: 82483
DTXSID: DTXSID60145042
UNII: W9QF6TE2SH
EC Number: 233-573-2
Nikkaji: J130.657J

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 12
Formal charge: 0
Complexity: 155

Physicochemical properties

Melting point: 85.8 °C · 85.8°C
Boiling point: 243.28 °C · 243.28°C (rough estimate)
Density: 0.9887 · 0.9887 (rough estimate)
refractive index: 1.544 · 1.5440 (estimate)
storage temp.: Sealed in dry,Room Temperature
pka: 9.84 · 9.84±0.40(Predicted)
Appearance: Light brown to brown Solid
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 318 · H318-H335-H315-H302+H312+H332
Precautionary statements: 280 · P280-P301+P312-P362+P364
HS Code: 2906290090 · 2906290090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.