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| Name |
cis-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid |
EINECS | N/A |
| CAS No. | 807320-43-0 | Density | 1.41 |
| PSA | 76.49000 | LogP | 1.72210 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H13 N O4 | Boiling Point | N/A |
| Molecular Weight | 247.251 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylicacid, 1'-oxo-, cis- (9CI) |
cis-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid Chemical Properties
Molecular Structure of cis-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid (CAS No.807320-43-0):
Molecular Formula: C13H13NO4
Molecular Weight: 247.2466
CAS No: 807320-43-0
Systematic Name: 1'-Oxo-1'H-spiro[cyclohexane-1,3'-furo[3,4-c]pyridine]-4-carboxylic acid
H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 65.49 Å2
Index of Refraction: 1.613
Molar Refractivity: 60.99 cm3
Molar Volume: 175.1 cm3
Surface Tension: 66.8 dyne/cm
Density: 1.41 g/cm3
Flash Point: 279.6 °C
Enthalpy of Vaporization: 85.88 kJ/mol
Boiling Point: 538.7 °C at 760 mmHg
Vapour Pressure: 1.95E-12 mmHg at 25°C
InChI: InChI=1/C13H13NO4/c15-11(16)8-1-4-13(5-2-8)10-7-14-6-3-9(10)12(17)18-13/h3,6-8H,1-2,4-5H2,(H,15,16)
InChIKey: PJCKCWRHRYXELD-UHFFFAOYAL
Std. InChI: InChI=1S/C13H13NO4/c15-11(16)8-1-4-13(5-2-8)10-7-14-6-3-9(10)12(17)18-13/h3,6-8H,1-2,4-5H2,(H,15,16)
Std. InChIKey: PJCKCWRHRYXELD-UHFFFAOYSA-N
cis-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid Specification
cis-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid (CAS No.807320-43-0), it also can be called 1'-Oxo-1'H-spiro[cyclohexane-1,3'-furo[3,4-c]pyridine]-4-carboxylic acid ; Spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid, 1'-oxo- ; 1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid ; trans-1'-Oxo-spiro[cyclohexane-1,3'(1'H)-furo[3,4-c]pyridine]-4-carboxylic acid .
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