(2-chlorophenyl) dihydrogen phosphite

C6H6ClO3P — CID 22639248

IUPAC(2-chlorophenyl) dihydrogen phosphite
SMILESOP(O)Oc1ccccc1Cl
InChIInChI=1S/C6H6ClO3P/c7-5-3-1-2-4-6(5)10-11(8)9/h1-4,8-9H
InChIKeyGEVHXEAPBRXYRO-UHFFFAOYSA-N
MW192.54 g/mol
LogP1.93
Rot. Bonds2

About (2-chlorophenyl) dihydrogen phosphite

(2-chlorophenyl) dihydrogen phosphite (PubChem CID 22639248) has the molecular formula C6H6ClO3P and a molecular weight of 192.54 g/mol. Its IUPAC name is (2-chlorophenyl) dihydrogen phosphite.

Molecular Properties

Compound Name(2-chlorophenyl) dihydrogen phosphite
PubChem CID22639248
Molecular FormulaC6H6ClO3P
Molecular Weight192.54 g/mol
Exact Mass191.97
IUPAC Name(2-chlorophenyl) dihydrogen phosphite
SMILESOP(O)Oc1ccccc1Cl
InChIInChI=1S/C6H6ClO3P/c7-5-3-1-2-4-6(5)10-11(8)9/h1-4,8-9H
InChIKeyGEVHXEAPBRXYRO-UHFFFAOYSA-N
XLogP1.93
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.54
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[chloromethyl(methyl)amino] (2-chlorophenyl) hydrogen phosphite
CID 151093801
1-chloro-2-methoxybenzene
CID 13011
1-chloro-2-(trideuteriomethoxy)benzene
CID 162343627
(2-chlorophenoxy)-dipentylphosphane
CID 134288679
2-(2-chlorophenoxy)propanedioate
CID 19095840
(2-chlorophenyl) nitrate
CID 141071843
2-chloro-6-(2-chlorophenoxy)phenol
CID 101247244
(2-chlorophenyl)phosphonous acid
CID 89079880
1-chloro-2-(dichloroamino)oxybenzene
CID 174531123
(2-chlorophenyl) dihydrogen phosphate dichloride
CID 20976937
azane;1-chloro-2-phenoxybenzene
CID 68980819
(2-chlorophenyl) ethaneperoxoate
CID 23043492

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl) dihydrogen phosphite?
The IUPAC name of (2-chlorophenyl) dihydrogen phosphite (CID 22639248) is (2-chlorophenyl) dihydrogen phosphite.
What is the SMILES notation for (2-chlorophenyl) dihydrogen phosphite?
The canonical SMILES for (2-chlorophenyl) dihydrogen phosphite is OP(O)Oc1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl) dihydrogen phosphite?
The InChIKey is GEVHXEAPBRXYRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClO3P/c7-5-3-1-2-4-6(5)10-11(8)9/h1-4,8-9H.
What are the key properties of (2-chlorophenyl) dihydrogen phosphite?
(2-chlorophenyl) dihydrogen phosphite has a molecular weight of 192.54 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl) dihydrogen phosphite is sourced from PubChem (CID 22639248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).