Mannose,3-amino-3,6-dideoxy- supplier

Name
mycosamine
EINECS
CAS No. 527-38-8
Article Data2
CAS DataBase
Density 1.406g/cm³
Solubility
Melting Point
Formula C₆H₁₃NO₄
Boiling Point 349.2 °C at 760 mmHg
Molecular Weight 163.174
Flash Point 165 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms mycosamine;3-Amino-3,6-dideoxymannose;3-Amino-3-desoxy-D-rhamnose;Mycosamin;Mannose,3-aMino-3,6-dideoxy-
PSA 95.94000
LogP -1.52710

Mannose,3-amino-3,6-dideoxy- Specification

The Mannose,3-amino-3,6-dideoxy-, with CAS registry number 527-38-8, has the systematic name of 3-amino-3,6-dideoxy-β-D-mannopyranose. Besides this, it is also called 3-Amino-3,6-dideoxymannose. Its classification code is Antibiotics. And the chemical formula of this chemical is C₆H₁₃NO₄.

Physical properties of Mannose,3-amino-3,6-dideoxy-: (1)# of Rule of 5 Violations: 1; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1.2; (6)#H bond acceptors: 5; (7)#H bond donors: 5; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 95.94 Å²; (10)Index of Refraction: 1.563; (11)Molar Refractivity: 37.69 cm³; (12)Molar Volume: 116 cm³; (13)Polarizability: 14.94×10^-24cm³; (14)Surface Tension: 53.7 dyne/cm; (15)Density: 1.406 g/cm³; (16)Flash Point: 165 °C; (17)Enthalpy of Vaporization: 68.75 kJ/mol; (18)Boiling Point: 349.2 °C at 760 mmHg; (19)Vapour Pressure: 2.89E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N[C@H]1[C@H](O)[C@@H](C)O[C@@H](O)[C@H]1O
(2)InChI: InChI=1/C6H13NO4/c1-2-4(8)3(7)5(9)6(10)11-2/h2-6,8-10H,7H2,1H3/t2-,3+,4-,5+,6-/m1/s1
(3)InChIKey: OINCELAOJGBMQV-FDROIEKHBT
(4)Std. InChI: InChI=1S/C6H13NO4/c1-2-4(8)3(7)5(9)6(10)11-2/h2-6,8-10H,7H2,1H3/t2-,3+,4-,5+,6-/m1/s1
(5)Std. InChIKey: OINCELAOJGBMQV-FDROIEKHSA-N

Product Name

mycosamine

Mannose,3-amino-3,6-dideoxy- Specification

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