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2776-56-9

Basic Information
CAS No.: 2776-56-9
Name: 6-Propyl-2-naphthol
Molecular Structure:
Molecular Structure of 2776-56-9 (6-Propyl-2-naphthol)
Formula: C13H14O
Molecular Weight: 186.25
Synonyms: 2-Naphthol,6-propyl- (6CI,7CI,8CI);2-Hydroxy-6-propylnaphthalene;2-Propyl-6-hydroxynaphthalene;6-Propyl-2-naphthol;6-Propylnaphthalen-2-ol;
Density: 1.087 g/cm3
Melting Point: 120-121 °C(Solv: ethanol (64-17-5))
Boiling Point: 335.3 °C at 760 mmHg
Flash Point: 161 °C
PSA: 20.23000
LogP: 3.49790
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  • 6-Propyl-2-naphthol

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    2776-56-9

    6-Propyl-2-naphthol

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    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four yearsOur key scientific leadership team has gained experience in top research and developmen

    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four years Our key scienti

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  • 6-Propyl-2-naphthol

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    6-Propyl-2-naphthol

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    1. high quality2. competitive price3. professional manufacturer4. best service122. loyal and honest supplier Application:Organic Chemicals

    ESUCCESS MATERIAL LIMITED

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  • 2-Naphthalenol,6-propyl-

  • Casno:

    2776-56-9

    2-Naphthalenol,6-propyl-

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    Manufacturer,strong R&D,professional team Storage:Store in a cool, dry place. Store in a tightly closed container. Package:according to your requirement Application:ZhiShang Chemical is owned by ZhiShang Group, is a professional new-type chemicals en

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  • 6-propylnaphthalen-2-ol

  • Casno:

    2776-56-9

    6-propylnaphthalen-2-ol

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    high purity Application:Drug intermediates Materials intermediates and active molecules

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

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Specification

The 6-Propyl-2-naphthol is an organic compound with the formula C13H14O. The IUPAC name of this chemical is 6-propylnaphthalen-2-ol. With the CAS registry number 2776-56-9, it is also named as 2-Naphthalenol, 6-propyl-. The product's category is Naphthalene Derivatives. In addition, the molecular weight is 186.25. 

The other characteristics of 6-Propyl-2-naphthol can be summarized as: (1)ACD/LogP: 4.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.24; (4)ACD/LogD (pH 7.4): 4.23; (5)ACD/BCF (pH 5.5): 974.76; (6)ACD/BCF (pH 7.4): 969.22; (7)ACD/KOC (pH 5.5): 4797.83; (8)ACD/KOC (pH 7.4): 4770.54; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 60.15 cm3; (15)Molar Volume: 171.3 cm3; (16)Surface Tension: 44.5 dyne/cm; (17)Enthalpy of Vaporization: 60.12 kJ/mol; (18)Vapour Pressure: 6.22E-05 mmHg at 25°C; (19)Rotatable Bond Count: 2; (20)Tautomer Count: 3; (21)Exact Mass: 186.104465; (22)MonoIsotopic Mass: 186.104465; (23)Topological Polar Surface Area: 20.2; (24)Heavy Atom Count: 14; (25)Complexity: 178.

People can use the following data to convert to the molecule structure. 
1. SMILES:Oc2ccc1c(ccc(c1)CCC)c2
2. InChI:InChI=1/C13H14O/c1-2-3-10-4-5-12-9-13(14)7-6-11(12)8-10/h4-9,14H,2-3H2,1H3 
3. InChIKey:AWQKULXTGASLSW-UHFFFAOYAH
4. Std. InChI:InChI=1S/C13H14O/c1-2-3-10-4-5-12-9-13(14)7-6-11(12)8-10/h4-9,14H,2-3H2,1H3
5. Std. InChIKey:AWQKULXTGASLSW-UHFFFAOYSA-N