6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,4,5-pentol

6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,4,5-pentol

CAS: 3687-64-7

Formula: C12H22O11

SMILES: OCC1OC(OC2C(O)C(O)C(O)C(O)C2O)C(O)C(O)C1O

IUPAC: 6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,4,5-pentol

InChI: InChI=1/C12H22O11/c13-1-2-3(14)4(15)10(21)12(22-2)23-11-8(19)6(17)5(16)7(18)9(11)20/h2-21H,1H2

Composition: C (42.11%), H (6.48%), O (51.41%)

Molar Mass: 342.297

Atom Count: 45

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	9
Exact Mass	342.116211528
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	9
InChIKey	VCWMRQDBPZKXKG-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	68.19
Topological Polar Surface Area	200.53
Polarizability	28.91
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	3687-64-7		Quote Only