IUPAC Name: 3-Piperidin-4-yl-1H-indole
Synonyms of 1H-Indole,3-(4-piperidinyl)- (CAS NO.17403-09-7): 3-(4-Piperidinyl)-1H-indole ; 3-(Piperidin-4-yl)-1H-indole ; 3-Piperidin-4-yl-1H-indole
CAS NO: 17403-09-7
Molecular Formula: C13H16N2
Molecular Weight: 200.28
Molecular Structure:
EINECS: 241-425-3
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 1
Polar Surface Area: 8.17 Å2
Index of Refraction: 1.622
Molar Refractivity: 63.12 cm3
Molar Volume: 179.1 cm3
Surface Tension: 47.3 dyne/cm
Density: 1.118 g/cm3
Flash Point: 188.8 °C
Enthalpy of Vaporization: 63.78 kJ/mol
Boiling Point: 388.6 °C at 760 mmHg
Vapour Pressure: 3.03E-06 mmHg at 25°C
Melting Point: 222-224°C
SMILES: n1cc(c2ccccc12)C3CCNCC3 Copy
InChI: InChI=1/C13H16N2/c1-2-4-13-11(3-1)12(9-15-13)10-5-7-14-8-6-10/h1-4,9-10,14-15H,5-8H2 Copy
InChIKey: KAIRZPVWWIMPFT-UHFFFAOYAO
Std. InChI: InChI=1S/C13H16N2/c1-2-4-13-11(3-1)12(9-15-13)10-5-7-14-8-6-10/h1-4,9-10,14-15H,5-8H2 Copy
Std. InChIKey: KAIRZPVWWIMPFT-UHFFFAOYSA-N
Product Categories of 1H-Indole,3-(4-piperidinyl)- (CAS NO.17403-09-7): pharmacetical
Hazard Codes: Xi,C
Risk Statements: 34
R34: Causes burns.
Safety Statements: 26-36/37/39-45
S26: Ehen 1H-Indole,3-(4-piperidinyl)- (CAS NO.17403-09-7) is used,in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: 3259
Hazard Note: Irritant
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