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687-63-8

Basic Information
CAS No.: 687-63-8
Name: H-SER-GLY-OH
Article Data: 6
Molecular Structure:
Molecular Structure of 687-63-8 (H-SER-GLY-OH)
Formula: C5H10N2O4
Molecular Weight: 162.145
Synonyms: Glycine,N-L-seryl- (7CI,8CI);127: PN: EP2071334 SEQID: 139 claimed protein;127: PN:WO2009077864 SEQID: 139 claimed protein;16: PN: WO03052099 PAGE: 83 claimedprotein;436: PN: WO2005081628 SEQID: 1545 claimed protein;L-Serylglycine;NSC88482;Serylglycine;
Density: 1.432 g/cm3
Boiling Point: 577 °C at 760 mmHg
Flash Point: 302.7 °C
Solubility: Soluble in water (50 mg/ml -clear, colorless solution)
Appearance: White crystalline powder
PSA: 112.65000
LogP: -1.40200
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Specification

The Glycine, L-seryl-, with CAS registry number 687-63-8, belongs to the following product category: Amino Acid Derivatives. It has the systematic name of {[(2S)-2-ammonio-3-hydroxypropanoyl]amino}acetate. This chemical should be stored at the temperature of -15°C. And the chemical formula of this chemical is C5H10N2O4.

Physical properties of Glycine, L-seryl-: (1)ACD/LogP: -2.15; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.65; (4)ACD/LogD (pH 7.4): -4.96; (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: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 66.84 Å2; (13)Index of Refraction: 1.538; (14)Molar Refractivity: 35.43 cm3; (15)Molar Volume: 113.1 cm3; (16)Polarizability: 14.04×10-24cm3; (17)Surface Tension: 71.4 dyne/cm; (18)Density: 1.432 g/cm3; (19)Flash Point: 302.7 °C; (20)Enthalpy of Vaporization: 99.2 kJ/mol; (21)Boiling Point: 577 °C at 760 mmHg; (22)Vapour Pressure: 1.03E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCC([O-])=O)[C@@H]([NH3+])CO
(2)InChI: InChI=1/C5H10N2O4/c6-3(2-8)5(11)7-1-4(9)10/h3,8H,1-2,6H2,(H,7,11)(H,9,10)/t3-/m0/s1
(3)InChIKey: WOUIMBGNEUWXQG-VKHMYHEABY
(4)Std. InChI: InChI=1S/C5H10N2O4/c6-3(2-8)5(11)7-1-4(9)10/h3,8H,1-2,6H2,(H,7,11)(H,9,10)/t3-/m0/s1
(5)Std. InChIKey: WOUIMBGNEUWXQG-VKHMYHEASA-N