2-iodo-3-methylbenzamide

2-iodo-3-methylbenzamide

CAS: 887234-41-5

Formula: C8H8INO

SMILES: CC1=C(I)C(=CC=C1)C(N)=O

IUPAC: 2-iodo-3-methylbenzamide

InChI: InChI=1S/C8H8INO/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4H,1H3,(H2,10,11)

Composition: C (36.81%), H (3.09%), I (48.61%), N (5.37%), O (6.13%)

Molar Mass: 261.062

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	260.96506
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	ZDNGKYGLSXVGAA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.54
Topological Polar Surface Area	43.09
Polarizability	20.15
Ring Count	1
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	887234-41-5		$34.05-$301.38$34.05$87.01$301.38