-
Name
Crotonyl glycine
- EINECS
- CAS No. 71428-89-2
- Article Data6
- CAS DataBase
- Density 1.175 g/cm3
- Solubility
- Melting Point
- Formula C6H9NO3
- Boiling Point 398.1 °C at 760 mmHg
- Molecular Weight 143.142
- Flash Point 194.6 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms Crotonyl glycine
- PSA 66.40000
- LogP 0.15420
Crotonyl glycine Specification
This chemical is called Crotonyl glycine, and its systematic name is N-but-2-enoylglycine. With the molecular formula of C6H9NO3, its molecular weight is 143.1406. The CAS registry number of this chemical is 71428-89-2.
Other characteristics of the Crotonyl glycine can be summarised as followings: (1)ACD/LogP: -0.52; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 46.61 Å2; (7)Index of Refraction: 1.488; (8)Molar Refractivity: 35.09 cm3; (9)Molar Volume: 121.7 cm3; (10)Polarizability: 13.91×10-24cm3; (11)Surface Tension: 43.6 dyne/cm; (12)Density: 1.175 g/cm3; (13)Flash Point: 194.6 °C; (14)Enthalpy of Vaporization: 71.19 kJ/mol; (15)Boiling Point: 398.1 °C at 760 mmHg; (16)Vapour Pressure: 1.89E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(C=CC)NCC(=O)
2.InChI: InChI=1/C6H9NO3/c1-2-3-5(8)7-4-6(9)10/h2-3H,4H2,1H3,(H,7,8)(H,9,10)
3.InChIKey: WWJXRJJBIVSSNF-UHFFFAOYAO
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