Butanoic acid,1-naphthalenyl ester supplier

Name
1-NAPHTHYL BUTYRATE
EINECS 221-500-7
CAS No. 3121-70-8
Article Data4
CAS DataBase
Density 1.103 g/cm³
Solubility
Melting Point 95.5-96.5 °C
Formula C₁₄H₁₄O₂
Boiling Point 320.3 °C at 760 mmHg
Molecular Weight 214.264
Flash Point 117.2 °C
Transport Information
Appearance clear yellow liquid
Safety 23-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Butyricacid, 1-naphthyl ester (6CI,7CI,8CI);1-Naphthol, butyrate (8CI);1-Naphthylbutyrate;Butanoic acid 1-naphthyl ester;NSC 97269;a-Naphthyl butyrate;a-Naphthyl n-butyrate;
PSA 26.30000
LogP 3.54530

Butanoic acid,1-naphthalenyl ester Specification

The CAS register number of Butanoic acid,1-naphthalenyl ester is 3121-70-8. It also can be called as alpha-Naphthyl butyrate and the IUPAC name about this chemical is naphthalen-1-yl butanoate. The molecular formula about this chemical is C₁₄H₁₄O₂ and the molecular weight is 214.26. It belongs to the Aromatic Esters. When you are using it, please do not breathe vapour and avoid contact with skin and eyes.

Physical properties about Butanoic acid,1-naphthalenyl ester are: (1)ACD/LogP: 3.85; (2)ACD/LogD (pH 5.5): 3.85; (3)ACD/LogD (pH 7.4): 3.85; (4)ACD/BCF (pH 5.5): 495.42; (5)ACD/BCF (pH 7.4): 495.42; (6)ACD/KOC (pH 5.5): 2955.75; (7)ACD/KOC (pH 7.4): 2955.75; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 26.3Å²; (11)Index of Refraction: 1.58; (12)Molar Refractivity: 64.7 cm³; (13)Molar Volume: 194.1 cm³; (14)Polarizability: 25.64x10^-24cm³; (15)Surface Tension: 41.2 dyne/cm; (16)Flash Point: 117.2 °C; (17)Enthalpy of Vaporization: 56.19 kJ/mol; (18)Boiling Point: 320.3 °C at 760 mmHg; (19)Vapour Pressure: 0.000321 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Oc2cccc1ccccc12)CCC
(2)InChI: InChI=1/C14H14O2/c1-2-6-14(15)16-13-10-5-8-11-7-3-4-9-12(11)13/h3-5,7-10H,2,6H2,1H3
(3)InChIKey: XIVJNRXPRQKFRZ-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C14H14O2/c1-2-6-14(15)16-13-10-5-8-11-7-3-4-9-12(11)13/h3-5,7-10H,2,6H2,1H3
(5)Std. InChIKey: XIVJNRXPRQKFRZ-UHFFFAOYSA-N

Product Name

1-NAPHTHYL BUTYRATE

Butanoic acid,1-naphthalenyl ester Specification

Related Products

Hot Products