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202577-32-0

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Basic Information
CAS No.: 202577-32-0
Name: 5-(ADAMANT-1-YL-METHOXY)-PENTANAL
Article Data: 5
Molecular Structure:
Molecular Structure of 202577-32-0 (5-(ADAMANT-1-YL-METHOXY)-PENTANAL)
Formula: C16H26O2
Molecular Weight: 250.381
Synonyms: 5-(tricyclo[3.3.1.13,7]dec-1-ylmethoxy)pentanal;
Density: 1.036 g/cm3
Boiling Point: 349.1 °C at 760 mmHg
Flash Point: 140.1 °C
Appearance: Yellow oil
PSA: 26.30000
LogP: 3.58860
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Specification

The chemical with CAS registry number of 202577-32-0 is known as 5-(Adamantan-1-ylmethoxy)pentanal. The systematic name is 5-(Tricyclo[3.3.1.13,7]dec-1-ylmethoxy)pentanal. It belongs to product categories of Various Intermediates; Intermediates; Miscellaneous Reagents. In addition, the formula is C16H26O2 and the molecular weight is 250.38. What's more, this chemical is a yellow oil.

Physical properties about 5-(Adamantan-1-ylmethoxy)pentanal are: (1)ACD/LogP: 3.79; (2)ACD/LogD (pH 5.5): 3.79; (3)ACD/LogD (pH 7.4): 3.79; (4)ACD/BCF (pH 5.5): 443.99; (5)ACD/BCF (pH 7.4): 443.99; (6)ACD/KOC (pH 5.5): 2732.69; (7)ACD/KOC (pH 7.4): 2732.69; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 7; (10)Index of Refraction: 1.507; (11)Molar Refractivity: 71.91 cm3; (12)Molar Volume: 241.4 cm3; (13)Surface Tension: 41.4 dyne/cm; (14)Density: 1.036 g/cm3; (15)Flash Point: 140.1 °C; (16)Enthalpy of Vaporization: 59.35 kJ/mol; (17)Boiling Point: 349.1 °C at 760 mmHg; (18)Vapour Pressure: 4.82E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: O=CCCCCOCC12CC3CC(C1)CC(C2)C3
2. InChI: InChI=1/C16H26O2/c17-4-2-1-3-5-18-12-16-9-13-6-14(10-16)8-15(7-13)11-16/h4,13-15H,1-3,5-12H2
3. InChIKey: RKOWZXQOTUDIQG-UHFFFAOYAM
4. Std. InChI: InChI=1S/C16H26O2/c17-4-2-1-3-5-18-12-16-9-13-6-14(10-16)8-15(7-13)11-16/h4,13-15H,1-3,5-12H2
5. Std. InChIKey: RKOWZXQOTUDIQG-UHFFFAOYSA-N