4-Octenoic acid,8-amino- supplier

Name
8-aminooct-4-enoic acid
EINECS 259-608-1
CAS No. 55348-89-5
Density 1.03 g/cm³
Solubility
Melting Point
Formula C₈H₁₅NO₂
Boiling Point 293.9 °C at 760 mmHg
Molecular Weight 157.213
Flash Point 131.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 8-Amino-4-octenoicacid;
PSA 63.32000
LogP 1.84660

4-Octenoic acid,8-amino- Specification

The 4-Octenoic acid,8-amino-, with CAS registry number 55348-89-5, has the systematic name of (4E)-8-aminooct-4-enoic acid. Besides this, it is also called 8-aminooct-4-enoic acid. Its molecular weight is 157.2102. And the chemical formula of this chemical is C₈H₁₅NO₂. What's more, its EINECS is 259-608-1.

Physical properties of 4-Octenoic acid,8-amino-: (1)ACD/LogP: 0.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.79; (4)ACD/LogD (pH 7.4): -1.75; (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: 7; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.492; (14)Molar Refractivity: 44.26 cm³; (15)Molar Volume: 152.5 cm³; (16)Polarizability: 17.54×10^-24cm³; (17)Surface Tension: 42 dyne/cm; (18)Density: 1.03 g/cm³; (19)Flash Point: 131.5 °C; (20)Enthalpy of Vaporization: 58.69 kJ/mol; (21)Boiling Point: 293.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000412 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CC/C=C/CCCN
(2)InChI: InChI=1/C8H15NO2/c9-7-5-3-1-2-4-6-8(10)11/h1-2H,3-7,9H2,(H,10,11)/b2-1+
(3)InChIKey: VIBUBBGZNCHOEE-OWOJBTEDBH
(4)Std. InChI: InChI=1S/C8H15NO2/c9-7-5-3-1-2-4-6-8(10)11/h1-2H,3-7,9H2,(H,10,11)/b2-1+
(5)Std. InChIKey: VIBUBBGZNCHOEE-OWOJBTEDSA-N

Product Name

8-aminooct-4-enoic acid

4-Octenoic acid,8-amino- Specification

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