3-hydroxy-2-iodocyclohex-2-en-1-one

3-hydroxy-2-iodocyclohex-2-en-1-one

CAS: 642088-17-3

Formula: C6H7IO2

SMILES: OC1=C(I)C(=O)CCC1

IUPAC: 3-hydroxy-2-iodocyclohex-2-en-1-one

InChI: InChI=1S/C6H7IO2/c7-6-4(8)2-1-3-5(6)9/h8H,1-3H2

Composition: C (30.28%), H (2.96%), I (53.32%), O (13.44%)

Molar Mass: 238.024

Atom Count: 16

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	237.94907
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FEFGOJAUQXBSDP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.74
Topological Polar Surface Area	37.3
Polarizability	16.78
Ring Count	1
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	642088-17-3		$184.20-$1,876.55$184.20$303.88$466.57$667.59$1,876.55

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	642088-17-3		$98.36-$1,511.94$98.36$195.46$326.60$489.27$1,511.94