methoxy(2-phenylethyl)arsane

C9H13AsO — CID 173113420

IUPACmethoxy(2-phenylethyl)arsane
SMILESCO[AsH]CCc1ccccc1
InChIInChI=1S/C9H13AsO/c1-11-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKeyPISMJCMUNAXDPP-UHFFFAOYSA-N
MW212.12 g/mol
LogP1.65
Rot. Bonds4

About methoxy(2-phenylethyl)arsane

methoxy(2-phenylethyl)arsane (PubChem CID 173113420) has the molecular formula C9H13AsO and a molecular weight of 212.12 g/mol. Its IUPAC name is methoxy(2-phenylethyl)arsane.

Molecular Properties

Compound Namemethoxy(2-phenylethyl)arsane
PubChem CID173113420
Molecular FormulaC9H13AsO
Molecular Weight212.12 g/mol
Exact Mass212.02
IUPAC Namemethoxy(2-phenylethyl)arsane
SMILESCO[AsH]CCc1ccccc1
InChIInChI=1S/C9H13AsO/c1-11-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKeyPISMJCMUNAXDPP-UHFFFAOYSA-N
XLogP1.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.12
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxy(2-phenylethyl)arsane?
The IUPAC name of methoxy(2-phenylethyl)arsane (CID 173113420) is methoxy(2-phenylethyl)arsane.
What is the SMILES notation for methoxy(2-phenylethyl)arsane?
The canonical SMILES for methoxy(2-phenylethyl)arsane is CO[AsH]CCc1ccccc1.
What is the InChIKey of methoxy(2-phenylethyl)arsane?
The InChIKey is PISMJCMUNAXDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13AsO/c1-11-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3.
What are the key properties of methoxy(2-phenylethyl)arsane?
methoxy(2-phenylethyl)arsane has a molecular weight of 212.12 g/mol, XLogP of 1.65, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(2-phenylethyl)arsane is sourced from PubChem (CID 173113420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).