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32899-77-7

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Basic Information
CAS No.: 32899-77-7
Name: DL-Glutamic acid, 4-(1-piperidinyl)-, diastereomer A
Molecular Structure:
Molecular Structure of 32899-77-7 (DL-Glutamic acid, 4-(1-piperidinyl)-, diastereomer A)
Formula: C10H18N2O4
Molecular Weight: 230.264
Synonyms: Glutamic acid, 4-piperidino-, DL- (8CI);(2S)-2-Amino-4-(piperidin-1-yl)pentanedioic acid;4-(1-Piperidinyl)-L-glutamic acid;L-Glutamic acid, 4-(1-piperidinyl)-;
Density: 1.308 g/cm3
Boiling Point: 424.9 °C at 760 mmHg
Flash Point: 210.8 °C
PSA: 103.86000
LogP: 0.36570
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Specification

The DL-Glutamic acid, 4-(1-piperidinyl)-, diastereomer A, with the CAS registry number 32899-77-7, is also known as 4-(1-Piperidinyl)-L-glutamic acid. This chemical's molecular formula is C10H18N2O4 and molecular weight is 230.26. What's more, its systematic name is (2S)-2-amino-4-(piperidin-1-yl)pentanedioic acid. Its classification code is Drug/Therapeutic Agent. 

Physical properties of DL-Glutamic acid, 4-(1-piperidinyl)-, diastereomer A are: (1)ACD/LogP: 0.64; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/KOC (pH 5.5): 1; (5)#H bond acceptors: 6; (6)#H bond donors: 4; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 59.08 Å2; (9)Index of Refraction: 1.553; (10)Molar Refractivity: 56.37 cm3; (11)Molar Volume: 175.9 cm3; (12)Polarizability: 22.35×10-24cm3; (13)Surface Tension: 63.8 dyne/cm; (14)Density: 1.308 g/cm3; (15)Flash Point: 210.8 °C; (16)Enthalpy of Vaporization: 74.52 kJ/mol; (17)Boiling Point: 424.9 °C at 760 mmHg; (18)Vapour Pressure: 2.07E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)CC(C(=O)O)N1CCCCC1
(2)InChI: InChI=1S/C10H18N2O4/c11-7(9(13)14)6-8(10(15)16)12-4-2-1-3-5-12/h7-8H,1-6,11H2,(H,13,14)(H,15,16)/t7-,8?/m0/s1
(3)InChIKey: YIKWBGMEIPZPAQ-JAMMHHFISA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1800mg/kg (1800mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA		 Pharmaceutical Chemistry Journal Vol. 20, Pg. 647, 1986.