Methyl 3-Methoxy-2-naphthoate
Basic information
- CAS
13041-60-6- Standard SMILES
COC(=O)c1cc2ccccc2cc1OC- InChIKey
MPLSAOVNAXJHHI-UHFFFAOYSA-N- Molecular formula
- C13H12O3
- Average molar mass
- 216.23 g/mol
- Monoisotopic mass
- 216.07864424
Names & identifiers
- Preferred name
- Methyl 3-Methoxy-2-naphthoate
- IUPAC
- methyl 3-methoxynaphthalene-2-carboxylate
- English name
- Methyl 3-methoxy-2-naphthoate
- Molecular formula
- C13H12O3
- Molecular weight
- 216.23
Names & synonyms
Methyl 3-methoxy-2-naphthoateDTXSID00304838RefChem:157504DTXCID70255969621-448-9MPLSAOVNAXJHHI-UHFFFAOYSA-N13041-60-6methyl 3-methoxynaphthalene-2-carboxylateMFCD004542533-Methoxy-2-naphthoic Acid Methyl Ester2-Naphthalenecarboxylic acid, 3-methoxy-, methyl estermethyl-3-methoxy-2-naphthoat
Show more names
Methyl3-Methoxy-2-naphthoate>METHYL 3-METHOXY-2-NAPHTHOATE 98%3-METHOXY-2-NAPHTOIC ACID METHYL ESTER
3-methoxy-2-naphthalenecarboxylic acid methyl esterNSC1675263-Methoxynaphthalene-2-carboxylic acid methyl esterSCHEMBL620668methyl 2-methoxy-3-naphthoatemethyl 3-methoxyl-2-naphthoatemethyl 3- methoxy-2-naphthoateMethyl3-Methoxy-2-naphthoate>
Database identifiers
- CAS
13041-60-6- PubChem CID
- 296952
- DTXSID
DTXSID00304838- EC Number
- 621-448-9
- Nikkaji
- J1.103.560D
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 252
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 48 · 48-51 °C(lit.)
- Boiling point
- 217 °C · 217 °C / 30mmHg
- Density
- 1.166 · 1.166±0.06 g/cm3(Predicted)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Room temperature.
- solubility
- soluble in Methanol
- form
- powder to crystal
- color
- White to Light yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- HS Code
- 2918.99 · 2918.99.4700
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
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 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 2918.99.4700
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
20 records
Compound notes
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