3,8,9-trioxatricyclo[4.2.1.0²,?]nonan-5-ol

3,8,9-trioxatricyclo[4.2.1.0²,?]nonan-5-ol

CAS: 3868-03-9

Formula: C6H8O4

SMILES: OC1C2OC2C2OCC1O2

IUPAC: 3,8,9-trioxatricyclo[4.2.1.0²,?]nonan-5-ol

InChI: InChI=1/C6H8O4/c7-3-2-1-8-6(9-2)5-4(3)10-5/h2-7H,1H2

Composition: C (50.00%), H (5.60%), O (44.40%)

Molar Mass: 144.126

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	5
Exact Mass	144.042258738
Formal Charge	0
FSP3	1
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	RXDFVNWKKAAOSK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	28.9
Topological Polar Surface Area	51.22
Polarizability	12.48
Ring Count	3
Rotatable Bond Count	0

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	3868-03-9		Quote Only