(2-iodophenyl)-phosphanylmethanone

C7H6IOP — CID 71171562

IUPAC(2-iodophenyl)-phosphanylmethanone
SMILESO=C(P)c1ccccc1I
InChIInChI=1S/C7H6IOP/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,10H2
InChIKeyLNRHGNHZLRILQR-UHFFFAOYSA-N
MW264.00 g/mol
LogP2.31
Rot. Bonds1

About (2-iodophenyl)-phosphanylmethanone

(2-iodophenyl)-phosphanylmethanone (PubChem CID 71171562) has the molecular formula C7H6IOP and a molecular weight of 264.00 g/mol. Its IUPAC name is (2-iodophenyl)-phosphanylmethanone.

Molecular Properties

Compound Name(2-iodophenyl)-phosphanylmethanone
PubChem CID71171562
Molecular FormulaC7H6IOP
Molecular Weight264.00 g/mol
Exact Mass263.92
IUPAC Name(2-iodophenyl)-phosphanylmethanone
SMILESO=C(P)c1ccccc1I
InChIInChI=1S/C7H6IOP/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,10H2
InChIKeyLNRHGNHZLRILQR-UHFFFAOYSA-N
XLogP2.31
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.00
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-iodobenzamide
CID 160670857
dichloromethane;2-iodobenzoyl chloride
CID 174929981
N-(1,3-dihydroxypropan-2-yl)-2-iodobenzamide
CID 65312404
(2-iodobenzoyl)oxyboronic acid
CID 134957148
4-(2-iodophenyl)-4-oxobutanoic acid
CID 24727008
phenyl 2-iodobenzoate
CID 11416063
1-iodo-2-(1,2,2-triiodoethenyl)benzene
CID 139766406
2-iodobenzoyl isothiocyanate
CID 15650510
1-(2-iodophenyl)-2-nitroethanone
CID 130707599
(2-iodophenyl)-(4-phenylphenyl)methanone
CID 43337741
(2-iodophenyl)-piperidin-1-ylmethanone
CID 962070
methyl 3-(2-iodophenyl)-3-oxopropanoate
CID 2759370

Frequently Asked Questions

What is the IUPAC name of (2-iodophenyl)-phosphanylmethanone?
The IUPAC name of (2-iodophenyl)-phosphanylmethanone (CID 71171562) is (2-iodophenyl)-phosphanylmethanone.
What is the SMILES notation for (2-iodophenyl)-phosphanylmethanone?
The canonical SMILES for (2-iodophenyl)-phosphanylmethanone is O=C(P)c1ccccc1I.
What is the InChIKey of (2-iodophenyl)-phosphanylmethanone?
The InChIKey is LNRHGNHZLRILQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6IOP/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,10H2.
What are the key properties of (2-iodophenyl)-phosphanylmethanone?
(2-iodophenyl)-phosphanylmethanone has a molecular weight of 264.00 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-iodophenyl)-phosphanylmethanone is sourced from PubChem (CID 71171562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).