-
Name
Fosmidomycin
- EINECS
- CAS No. 66508-53-0
- Article Data6
- CAS DataBase
- Density 1.6±0.1 g/cm3
- Solubility
- Melting Point 158-160° (dec); mp 160-166° (dec) (Hemmi)
- Formula C4H9NNaO5P
- Boiling Point 463.7±55.0 °C at 760 mmHg
- Molecular Weight 183.10
- Flash Point 234.3±31.5 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Phosphonic acid, [3-(formylhydroxyamino)- propyl]-;Antibiotic FR 31705;(3-(Formylhydroxyamino)propyl)phosphonic acid monosodium salt;3-(N-Formyl-N-hydroxyamino)-propylphosphonic acid;3-(formyl-hydroxy-amino)propylphosphonic acid;(3-(Formylhydroxyamino)propyl)phosphonic acid, monosodium salt;(3-(N-Hydroxyformamido)propyl)phosphonic acid;Phosphonic acid, (3-(formylhydroxyamino)propyl)-, monosodium salt;
- PSA 107.88000
- LogP 0.03770
Fosmidomycin Specification
The Fosmidomycin, with the CAS registry number 66508-53-0, is also known as 3-(N-Formyl-N-hydroxyamino)-propylphosphonic acid. This chemical's molecular formula is C4H10NO5P and molecular weight is 183.10. What's more, its systematic name is {3-[Formyl(hydroxy)amino]propyl}phosphonic acid.
Physical properties of Fosmidomycin are: (1)ACD/LogP: -2.47±0.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.37; (4)ACD/LogD (pH 7.4): -6.07; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 107.88 Å2; (13)Index of Refraction: 1.533; (14)Molar Refractivity: 36.0±0.3 cm3; (15)Molar Volume: 115.8±3.0 cm3; (16)Polarizability: 14.3±0.5×10-24cm3; (17)Surface Tension: 81.7±3.0 dyne/cm; (18)Density: 1.6±0.1 g/cm3; (19)Flash Point: 234.3±31.5 °C; (20)Enthalpy of Vaporization: 79.4±6.0 kJ/mol; (21)Boiling Point: 463.7±55.0 °C at 760 mmHg; (22)Vapour Pressure: 0.0±2.5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: C(CN(C=O)O)CP(=O)(O)O
(2)Std. InChI: InChI=1S/C4H10NO5P/c6-4-5(7)2-1-3-11(8,9)10/h4,7H,1-3H2,(H2,8,9,10)
(3)Std. InChIKey: GJXWDTUCERCKIX-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View