2-Furancarboxylic acid,5-(1-piperidinylmethyl)- supplier

Name
5-PIPERIDIN-1-YLMETHYL-FURAN-2-CARBOXYLIC ACID
EINECS
CAS No. 301353-36-6
Density 1.222 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₅NO₃
Boiling Point 340.4 °C at 760 mmHg
Molecular Weight 209.245
Flash Point 159.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 5-(Piperidin-1-ylmethyl)furan-2-carboxylicacid;
PSA 53.68000
LogP 1.90160

2-Furancarboxylic acid,5-(1-piperidinylmethyl)- Specification

The 2-Furancarboxylic acid, 5-(1-piperidinylmethyl)-, with the CAS registry number 301353-36-6, is also known as 5-(Piperidin-1-ylmethyl)-2-furoic acid. This chemical's molecular formula is C₁₁H₁₅NO₃ and molecular weight is 209.24. What's more, its IUPAC name is 5-(Piperidin-1-ylmethyl)furan-2-carboxylic acid. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 2-Furancarboxylic acid, 5-(1-piperidinylmethyl)- are: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.32; (4)ACD/LogD (pH 7.4): -1.58; (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: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.68 Å²; (13)Index of Refraction: 1.556; (14)Molar Refractivity: 55.02 cm³; (15)Molar Volume: 171.1 cm³; (16)Polarizability: 21.81×10^-24 cm³; (17)Surface Tension: 50.6 dyne/cm; (18)Density: 1.222 g/cm³; (19)Flash Point: 159.7 °C; (20)Enthalpy of Vaporization: 61.63 kJ/mol; (21)Boiling Point: 340.4 °C at 760 mmHg; (22)Vapour Pressure: 3.34E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1oc(cc1)CN2CCCCC2
(2) InChI: InChI=1/C11H15NO3/c13-11(14)10-5-4-9(15-10)8-12-6-2-1-3-7-12/h4-5H,1-3,6-8H2,(H,13,14)
(3) InChIKey: FOMTWLBLESUJEU-UHFFFAOYAD

Product Name

5-PIPERIDIN-1-YLMETHYL-FURAN-2-CARBOXYLIC ACID

2-Furancarboxylic acid,5-(1-piperidinylmethyl)- Specification

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