Cyclopentanecarboxylicacid, 3-amino- supplier

Name
3-AMINOCYCLOPENTANECARBOXYLIC ACID
EINECS
CAS No. 89614-96-0
Article Data5
CAS DataBase
Density 1.19 g/cm³
Solubility
Melting Point 240-241 °C (decomp)
Formula C₆H₁₁NO₂
Boiling Point 264.7 °C at 760 mmHg
Molecular Weight 129.159
Flash Point 113.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-aminocyclopentane-1-carboxylic acid
PSA 63.32000
LogP 0.89870

Cyclopentanecarboxylicacid, 3-amino- Specification

The Cyclopentanecarboxylicacid, 3-amino-, with CAS registry number 89614-96-0, belongs to the following product categories: (1)Carboxylicacid; (2)AminoAcid; (3)Pharmacetical. It has the systematic name of 3-aminocyclopentanecarboxylic acid. And the chemical formula of this chemical is C₆H₁₁NO₂.

Physical properties of Cyclopentanecarboxylicacid, 3-amino-: (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)Polarizability: 12.97×10^-24cm³; (17)Surface Tension: 49.9 dyne/cm; (18)Enthalpy of Vaporization: 55.33 kJ/mol; (19)Vapour Pressure: 0.00278 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C1CC(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)
(3)InChIKey: MLLSSTJTARJLHK-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H11NO2/c7-5-2-1-4(3-5)6(8)9/h4-5H,1-3,7H2,(H,8,9)
(5)Std. InChIKey: MLLSSTJTARJLHK-UHFFFAOYSA-N

Product Name

3-AMINOCYCLOPENTANECARBOXYLIC ACID

Cyclopentanecarboxylicacid, 3-amino- Specification

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