3-(dimethylamino)propyl 2-iodobenzoate

3-(dimethylamino)propyl 2-iodobenzoate

Formula: C12H16INO2

SMILES: CN(C)CCCOC(=O)C1=CC=CC=C1I

IUPAC: 3-(dimethylamino)propyl 2-iodobenzoate

InChI: InChI=1S/C12H16INO2/c1-14(2)8-5-9-16-12(15)10-6-3-4-7-11(10)13/h3-4,6-7H,5,8-9H2,1-2H3

Composition: C (43.26%), H (4.84%), I (38.09%), N (4.20%), O (9.60%)

Molar Mass: 333.169

Atom Count: 32

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	333.02257
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	XAYCFSGUBJCCJC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.33
Topological Polar Surface Area	29.54
Polarizability	28.75
Ring Count	1
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H16INO2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00