3-(1H-indol-3-yl)-2-{[(5-methylfuran-2-yl)carbonyl]amino}propanoate supplier

Name
3-(1H-INDOL-3-YL)-2-[(5-METHYL-FURAN-2-CARBONYL)-AMINO]-PROPIONIC ACID
EINECS
CAS No. 360573-13-3
Density
Solubility
Melting Point
Formula C₁₇H₁₅N₂O₄
Boiling Point 601.3 °C at 760 mmHg
Molecular Weight 311.3125
Flash Point 317.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 3-(1H-INDOL-3-YL)-2-[(5-METHYL-FURAN-2-CARBONYL)-AMINO]-PROPIONIC ACID;TIMTEC-BB SBB012325
PSA 95.33000
LogP 2.88590

3-(1H-indol-3-yl)-2-{[(5-methylfuran-2-yl)carbonyl]amino}propanoate Specification

The 3-(1H-indol-3-yl)-2-{[(5-methylfuran-2-yl)carbonyl]amino}propanoate is an organic compound with the formula C₁₇H₁₅N₂O₄. With the CAS registry number 360573-13-3, the IUPAC name of this chemical is (2R)-3-(1H-indol-3-yl)-2-[(5-methylfuran-2-carbonyl)amino]propanoate.

Physical properties about 3-(1H-indol-3-yl)-2-{[(5-methylfuran-2-yl)carbonyl]amino}propanoate are: (1)ACD/LogP: 1.98; (2)#H bond acceptors: 6; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 75.68 Å²; (6)Flash Point: 317.4 °C; (7)Enthalpy of Vaporization: 94.09 kJ/mol; (8)Boiling Point: 601.3 °C at 760 mmHg; (9)Vapour Pressure: 2.62E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@H](C([O-])=O)Cc2c1ccccc1nc2)c3oc(cc3)C
(2)InChI: InChI=1/C17H16N2O4/c1-10-6-7-15(23-10)16(20)19-14(17(21)22)8-11-9-18-13-5-3-2-4-12(11)13/h2-7,9,14,18H,8H2,1H3,(H,19,20)(H,21,22)/p-1/t14-/m0/s1
(3)InChIKey: JKKNHOYMARTPDL-WMYPJWEOBQ
(4)Std. InChI: InChI=1S/C17H16N2O4/c1-10-6-7-15(23-10)16(20)19-14(17(21)22)8-11-9-18-13-5-3-2-4-12(11)13/h2-7,9,14,18H,8H2,1H3,(H,19,20)(H,21,22)/p-1/t14-/m0/s1
(5)Std. InChIKey: JKKNHOYMARTPDL-AWEZNQCLSA-M

Product Name

3-(1H-INDOL-3-YL)-2-[(5-METHYL-FURAN-2-CARBONYL)-AMINO]-PROPIONIC ACID

3-(1H-indol-3-yl)-2-{[(5-methylfuran-2-yl)carbonyl]amino}propanoate Specification

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