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(1R,3S)-3-Aminocyclopentanecarboxylic acid

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Name

(1R,3S)-3-Aminocyclopentanecarboxylic acid

EINECS N/A
CAS No. 71830-08-5 Density 1.19 g/cm3
PSA 63.32000 LogP 0.89870
Solubility Slightly soluble in water. Melting Point 172.1 °C
Formula C6H11NO2 Boiling Point 264.7 °C at 760 mmHg
Molecular Weight 129.159 Flash Point 113.9 °C
Transport Information N/A Appearance off-white to beige crystalline powder
Safety 26-37/39 Risk Codes 20/21/22-36/37/38
Molecular Structure Molecular Structure of 71830-08-5 ((1R,3S)-3-Aminocyclopentanecarboxylic acid) Hazard Symbols HarmfulXn
Synonyms

Cyclopentanecarboxylicacid, 3-amino-, (1R-cis)-;(-)-cis-3-Aminocyclopentanecarboxylic acid;(1R,3S)-3-Aminocyclopentanecarboxylic acid;

Article Data 10

(1R,3S)-3-Aminocyclopentanecarboxylic acid Specification

The (1R,3S)-3-Aminocyclopentanecarboxylic acid, with the CAS registry number 71830-08-5, is also known as Cyclopentanecarboxylic acid, 3-amino-, (1R,3S)-. It belongs to the product categories of Aminoacid; Unusual Amino Acids; API Intermediates. This chemical's molecular formula is C6H11NO2 and formula weight is 129.16. What's more, this chemical is off-white to beige crystalline powder. 

Physical properties about (1R,3S)-3-Aminocyclopentanecarboxylic acid are: (1)ACD/LogP: -0.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3; (4)ACD/LogD (pH 7.4): -2.98; (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: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 32.71 cm3; (15)Molar Volume: 108.5 cm3; (16)Surface Tension: 49.9 dyne/cm; (17)Density: 1.19 g/cm3; (18)Melting Point 172.1 °C; (19)Flash Point: 113.9 °C; (20)Enthalpy of Vaporization: 55.33 kJ/mol; (21)Boiling Point: 264.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00278 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating / harmful to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@H]1C[C@@H](N)CC1
(2)InChI: InChI=1/C6H11NO2/c7-5-2-1-4(3-5)6(8)9/h4-5H,1-3,7H2,(H,8,9)/t4-,5+/m1/s1
(3)InChIKey: MLLSSTJTARJLHK-UHNVWZDZBF

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