Basic Information | Post buying leads | Suppliers |
Name |
(S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid |
EINECS | N/A |
CAS No. | 723284-83-1 | Density | 1.404 g/cm3 |
PSA | 81.78000 | LogP | 1.59010 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H11NO4 | Boiling Point | 381.9 °C at 760 mmHg |
Molecular Weight | 209.20 | Flash Point | 184.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(S)-B-(P-METHYLENEDIOXYPHENYL)-B-ALANINE;(S)-3-AMINO-3-(4-METHYLENEDIOXYPHENYL)PROPIONIC ACID;(S)-3-AMINO-3-(BENZO[D][1,3]DIOXOL-5-YL)PROPANOIC ACID;(S)-3-AMINO-3-BENZO[1,3]DIOXOL-5-YL-PROPIONIC ACID;(S)-3-AMINO-3-(3,4-METHYLENEDIOXYPHENYL)PROPIONIC ACID;RARECHEM LK HC S236;(S)-3-Amino-3-(3,4-methylendioxyphenyl)propionic acid |
This chemical is called (S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid, and its systematic name is (3S)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid. With the molecular formula of C10H11NO4, its molecular weight is 209.20. The CAS registry number of this chemical is 723284-83-1, and its product category is API Intermediates.
Other characteristics of the (S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid can be summarised as followings: (1)ACD/LogP: 0.77; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 48 Å2; (7)Index of Refraction: 1.61; (8)Molar Refractivity: 51.69 cm3; (9)Molar Volume: 148.9 cm3; (10)Polarizability: 20.49×10-24cm3; (11)Surface Tension: 68.4 dyne/cm; (12)Density: 1.404 g/cm3; (13)Flash Point: 184.8 °C; (14)Enthalpy of Vaporization: 66.48 kJ/mol; (15)Boiling Point: 381.9 °C at 760 mmHg; (16)Vapour Pressure: 1.63E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)C[C@@H](c1ccc2OCOc2c1)N/
2.InChI: InChI=1/C10H11NO4/c11-7(4-10(12)13)6-1-2-8-9(3-6)15-5-14-8/h1-3,7H,4-5,11H2,(H,12,13)/t7-/m0/s1
3.InChIKey: DJWMFJZOSZPAHI-ZETCQYMHBP