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1,3-Benzodioxole-5-propanoicacid, b-amino-, (bR)- (723284-85-3)

Identification
Name:1,3-Benzodioxole-5-propanoicacid, b-amino-, (bR)-
Synonyms:(R)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid;
CAS:723284-85-3
Molecular Formula: C10H11NO4
Molecular Weight: 209.2
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-/m1/s1
Molecular Structure: (C10H11NO4) (R)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid;
Properties
Density:1.404 g/cm3
Refractive index:1.61
Specification:

The (R)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid with the CAS number 723284-85-3 is also called 1,3-Benzodioxole-5-propanoicacid, b-amino-, (bR)-. The systematic name is (3R)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid. Its molecular formula is C10H11NO4. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the (R)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid are: (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)Enthalpy of Vaporization: 66.48 kJ/mol; (13)Vapour Pressure: 1.63×10-6 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-/m1/s1
(3)InChIKey: DJWMFJZOSZPAHI-SSDOTTSWBN

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