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| CAS No.: | 927-55-9 |
|---|---|
| Name: | 4-aminopentan-1-ol |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C5H13NO |
| Molecular Weight: | 103.164 |
| Synonyms: | 4-Amino-1-pentanol;NSC 1095; |
| EINECS: | 213-151-4 |
| Density: | 0.915 g/cm3 |
| Melting Point: | 32°C |
| Boiling Point: | 174.7 °C at 760 mmHg |
| Flash Point: | 59.4 °C |
| PSA: | 46.25000 |
| LogP: | 0.80640 |
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- Total:26 Page 1 of 1 1
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Specification
The 1-Pentanol, 4-amino-, with the CAS registry number 927-55-9, is also known as 4-Amino-1-pentanol. Its EINECS number is 213-151-4. This chemical's molecular formula is C5H13NO and molecular weight is 103.16. What's more, its IUPAC name is 4-Aminopentan-1-ol.
Physical properties of 1-Pentanol, 4-amino- are: (1)ACD/LogP: -0.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.52; (4)ACD/LogD (pH 7.4): -3.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 12.47Å2; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 30.24 cm3; (15)Molar Volume: 112.6 cm3; (16)Polarizability: 11.98×10-24 cm3; (17)Surface Tension: 35.1 dyne/cm; (18)Density: 0.915 g/cm3; (19)Flash Point: 59.4 °C; (20)Enthalpy of Vaporization: 47.85 kJ/mol; (21)Boiling Point: 174.7 °C at 760 mmHg; (22)Vapour Pressure: 0.369 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(CCCO)N
(2)InChI: InChI=1S/C5H13NO/c1-5(6)3-2-4-7/h5,7H,2-4,6H2,1H3
(3)InChIKey: JAXJUENAJXWFBX-UHFFFAOYSA-N