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3,3-dichloro-piperidin-2-one
Δ1-pyrroline-5-carboxylate
Conditions | Yield |
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With barium dihydroxide |
4-acetamido-4,4-bis(ethyloxycarbonyl)butyraldehyde
Δ1-pyrroline-5-carboxylate
Conditions | Yield |
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With hydrogenchloride |
Conditions | Yield |
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With 2,3-dimethoxy-5-methyl-6-(3-methyl-2-butenyl)-1,4-benzoquinone; proline dehydrogenase R1 from Deinococcus radiodurans In aq. phosphate buffer at 23℃; pH=7.5; Kinetics; Concentration; Reagent/catalyst; Enzymatic reaction; |
D-glycero-D-guloheptonic acid
Δ1-pyrroline-5-carboxylate
Conditions | Yield |
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With periodate |
Δ1-pyrroline-5-carboxylate
ethanol
2-aminobenzaldehyde
1-carboxy-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-b]quinazolinylium betaine
Δ1-pyrroline-5-carboxylate
(2S,4R)-<4-2H1>-proline
Conditions | Yield |
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With (4S-2H)-NADH; NosF gene from Escherichia colie; 2-amino-2-hydroxymethyl-1,3-propanediol In water at 42℃; |
Conditions | Yield |
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With (4R-2H)-NADH; NosF gene from Escherichia colie; 2-amino-2-hydroxymethyl-1,3-propanediol In water at 42℃; | |
With 1,4-dihydronicotinamide adenine dinucleotide; NosF gene from Escherichia coli; 2-amino-2-hydroxymethyl-1,3-propanediol In water at 42℃; pH=8; Enzyme kinetics; |
The IUPAC name of delta-1-Pyrroline-5-carboxylate is 3,4-dihydro-2H-pyrrole-2-carboxylic acid. With the CAS registry number 2906-39-0, it is also named as Pyrroline-5-carboxylate. In addition, its molecular formula is C5H7NO2 and molecular weight is 113.1146.
The other characteristics of delta-1-Pyrroline-5-carboxylate can be summarized as: (1)ACD/LogP: -1.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.17; (4)ACD/LogD (pH 7.4): -4.34; (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: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.66 Å2; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 27.79 cm3; (15)Molar Volume: 83.4 cm3; (16)Polarizability: 11.01×10-24cm3; (17)Surface Tension: 51.7 dyne/cm; (18)Density: 1.35 g/cm3; (19)Flash Point: 137.7 °C; (20)Enthalpy of Vaporization: 59.88 kJ/mol; (21)Boiling Point: 304.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000206 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(O)C1/N=C\CC1
(2)InChI: InChI=1/C5H7NO2/c7-5(8)4-2-1-3-6-4/h3-4H,1-2H2,(H,7,8)
(3)InChIKey: DWAKNKKXGALPNW-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C5H7NO2/c7-5(8)4-2-1-3-6-4/h3-4H,1-2H2,(H,7,8)
(5)Std. InChIKey: DWAKNKKXGALPNW-UHFFFAOYSA-N