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Name |
2-Naphthalenecarboxaldehyde,5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl- |
EINECS | N/A |
CAS No. | 17610-20-7 | Density | 0.955 g/cm3 |
PSA | 17.07000 | LogP | 4.15650 |
Solubility | N/A | Melting Point |
N/A |
Formula | C16H22O | Boiling Point | 324 °C at 760 mmHg |
Molecular Weight | 230.35 | Flash Point | 120.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Naphthaldehyde,5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl- (6CI,7CI,8CI);3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalene-2-carboxaldehyde;5,6,7,8-Tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenecarboxaldehyde;NSC 17410; |
The 2-Naphthalenecarboxaldehyde, 5, 6, 7, 8-tetrahydro-3, 5, 5, 8, 8-pentamethyl-, with the CAS registry number 17610-20-7, is also known as 3, 5, 5, 8, 8-Pentamethyl-5, 6, 7, 8-tetrahydro-2-naphthalenecarboxaldehyde. This chemical's molecular formula is C16H22O and molecular weight is 230.3531. What's more, its IUPAC name is 3, 5, 5, 8, 8-Pentamethyl-6, 7-dihydronaphthalene-2-carbaldehyde.
Physical properties about 2-Naphthalenecarboxaldehyde, 5, 6, 7, 8-tetrahydro-3, 5, 5, 8, 8-pentamethyl- are: (1)ACD/LogP: 5.85; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 17.07 Å2; (7)Index of Refraction: 1.519; (8)Molar Refractivity: 73.25 cm3; (9)Molar Volume: 241 cm3; (10)Polarizability: 29.04×10-24 cm3; (11)Surface Tension: 34 dyne/cm; (12)Density: 0.955 g/cm3; (13)Flash Point: 120.8 °C; (14)Enthalpy of Vaporization: 56.6 kJ/mol; (15)Boiling Point: 324 °C at 760 mmHg; (16)Vapour Pressure: 0.000252 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1c(cc2c(c1)C(CCC2(C)C)(C)C)C
(2) InChI: InChI=1/C16H22O/c1-11-8-13-14(9-12(11)10-17)16(4,5)7-6-15(13,2)3/h8-10H,6-7H2,1-5H3
(3) InChIKey: JEJZFUVABODMHT-UHFFFAOYAW