4-Methoxynaphthalene-1-carboxylic acid supplier

Name
4-methoxynaphthalene-1-carboxylate
EINECS 200-589-5
CAS No. 13041-62-8
Article Data6
CAS DataBase
Density
Solubility Soluble in DMSO and chloroform. Slightly soluble in water.
Melting Point 243-247℃
Formula C₁₂H₁₀O₃
Boiling Point 388.7 °C at 760 mmHg
Molecular Weight 202.21
Flash Point 155.8 °C
Transport Information
Appearance
Safety 26
Risk Codes 36-22
Molecular Structure
Hazard Symbols Xn
Synonyms 1-Naphthoicacid, 4-methoxy- (6CI,7CI,8CI);4-Methoxy-1-naphthalenecarboxylic acid;4-Methoxy-1-naphthoic acid;4-Methoxy-a-naphthoic acid;
PSA 49.36000
LogP 1.21190

4-Methoxynaphthalene-1-carboxylic acid Specification

The 4-Methoxy-1-naphthoic acid is a chemical compound with cas registry number of 13041-62-8. Both its systematic name and IUPAC name are the same which is called 4-methoxynaphthalene-1-carboxylate.

The physical properties about this chemical are: (1)ACD/LogP: 3.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.95; (4)ACD/LogD (pH 7.4): 0.36; (5)ACD/BCF (pH 5.5): 9.05; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 74.89; (8)ACD/KOC (pH 7.4): 1.9; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Flash Point: 155.8 °C; (13)Enthalpy of Vaporization: 67.29 kJ/mol; (14)Boiling Point: 388.7 °C at 760 mmHg; (15)Vapour Pressure: 9.72E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)c2c1ccccc1c(OC)cc2;
(2)InChI: InChI=1/C12H10O3/c1-15-11-7-6-10(12(13)14)8-4-2-3-5-9(8)11/h2-7H,1H3,(H,13,14)/p-1;(3)InChIKey: WRQHSQDGYYDRMX-REWHXWOFAV

Product Name

4-methoxynaphthalene-1-carboxylate

4-Methoxynaphthalene-1-carboxylic acid Specification

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