1-(3-bromopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane

1-(3-bromopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane

CAS: 89276-36-8

Formula: C9H15BrO3

SMILES: CC12COC(CCCBr)(OC1)OC2

IUPAC: 1-(3-bromopropyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane

InChI: InChI=1S/C9H15BrO3/c1-8-5-11-9(12-6-8,13-7-8)3-2-4-10/h2-7H2,1H3

Composition: C (43.05%), H (6.02%), Br (31.82%), O (19.11%)

Molar Mass: 251.12

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	250.020457
Formal Charge	0
FSP3	1
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DFJXYKOFAJADLL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.6
Topological Polar Surface Area	27.69
Polarizability	20.81
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	89276-36-8		$5,250.00$5,250.00