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CAS No.: | 10512-86-4 |
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Name: | N-FORMYL-L-ALANINE |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C4H7NO3 |
Molecular Weight: | 117.104 |
Synonyms: | Alanine,N-formyl-, L- (8CI);L-N-Formylalanine;N-Formyl-L-alanine;N-Formylalanine; |
EINECS: | 234-045-4 |
Density: | 1.223 g/cm3 |
Melting Point: | 147-148 °C |
Boiling Point: | 386.6 °C at 760 mmHg |
Flash Point: | 187.6 °C |
Safety: | 24/25 |
PSA: | 66.40000 |
LogP: | 0.23230 |
The L-Alanine, N-formyl- is an organic compound with the formula C4H7NO3. The IUPAC name of this chemical is 2-formamidopropanoic acid. With the CAS registry number 10512-86-4, it is also named as N-Formyl-L-alanine. The product's category is Glycinescaffold. Besides, it should be stored in a closed cool and dry place.
Physical properties about L-Alanine, N-formyl- are: (1)ACD/LogP: -0.61 ; (2)ACD/LogD (pH 5.5): -2.84; (3)ACD/LogD (pH 7.4): -4.21; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 46.61 Å2; (12)Index of Refraction: 1.453; (13)Molar Refractivity: 25.88 cm3; (14)Molar Volume: 95.6 cm3; (15)Polarizability: 10.26×10-24cm3; (16)Surface Tension: 44.6 dyne/cm; (17)Density: 1.223 g/cm3; (18)Flash Point: 187.6 °C; (19)Enthalpy of Vaporization: 69.77 kJ/mol; (20)Boiling Point: 386.6 °C at 760 mmHg; (21)Vapour Pressure: 4.73E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC=O)C
(2)InChI: InChI=1/C4H7NO3/c1-3(4(7)8)5-2-6/h2-3H,1H3,(H,5,6)(H,7,8)/t3-/m0/s1
(3)InChIKey: SRBATDDRZARFDZ-VKHMYHEABQ
(4)Std. InChI: InChI=1S/C4H7NO3/c1-3(4(7)8)5-2-6/h2-3H,1H3,(H,5,6)(H,7,8)/t3-/m0/s1
(5)Std. InChIKey: SRBATDDRZARFDZ-VKHMYHEASA-N