Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid supplier

Name
Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid
EINECS
CAS No. 270263-07-5
Density 1.292 g/cm³
Solubility
Melting Point
Formula C₂₃H₂₁NO₅
Boiling Point 616.4 °C at 760 mmHg
Molecular Weight 391.42
Flash Point 326.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Furanbutanoic acid, beta-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,(betaS)-;(3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-furan-2-ylbutanoic acid;N-(9-Fluorenylmethoxycarbonyl)-(S)-3-amino-4-(2-furyl)butanoic acid;N-beta-(9-Fluorenylmethoxycarbonyl)-L-homo(2-furyl)alanine;
PSA 88.77000
LogP 4.59500

Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid Specification

The Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid, with the CAS registry number 270263-07-5, is also known as N-(9-Fluorenylmethoxycarbonyl)-(S)-3-amino-4-(2-furyl)butanoic acid. It belongs to the product category of B-Amino. This chemical's molecular formula is C₂₃H₂₁NO₅ and molecular weight is 391.42. What's more, its systematic name is (3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-furan-2-ylbutanoic acid.

Physical properties of Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid are: (1)ACD/LogP: 4.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.48; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 126.38; (6)ACD/BCF (pH 7.4): 2.12; (7)ACD/KOC (pH 5.5): 473.54; (8)ACD/KOC (pH 7.4): 7.94; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 68.98 Å²; (13)Index of Refraction: 1.612; (14)Molar Refractivity: 105.33 cm³; (15)Molar Volume: 302.7 cm³; (16)Surface Tension: 55.9 dyne/cm; (17)Density: 1.292 g/cm³; (18)Flash Point: 326.6 °C; (19)Enthalpy of Vaporization: 96.12 kJ/mol; (20)Boiling Point: 616.4 °C at 760 mmHg; (21)Vapour Pressure: 4.72E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C[C@@H](NC(=O)OCC3c1ccccc1c2ccccc23)Cc4occc4
(2)InChI: InChI=1S/C23H21NO5/c25-22(26)13-15(12-16-6-5-11-28-16)24-23(27)29-14-21-19-9-3-1-7-17(19)18-8-2-4-10-20(18)21/h1-11,15,21H,12-14H2,(H,24,27)(H,25,26)/t15-/m0/s1
(3)InChIKey: YIYJEKXVMOCXPC-HNNXBMFYSA-N

Product Name

Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid

Fmoc-(S)-3-Amino-4-(2-furyl)-butyric acid Specification

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