dec-1-ynylarsane

C10H19As — CID 173084883

IUPACdec-1-ynylarsane
SMILESCCCCCCCCC#C[AsH2]
InChIInChI=1S/C10H19As/c1-2-3-4-5-6-7-8-9-10-11/h2-8,11H2,1H3
InChIKeyRURRZPQZNCNCIZ-UHFFFAOYSA-N
MW214.18 g/mol
LogP2.33
Rot. Bonds6

About dec-1-ynylarsane

dec-1-ynylarsane (PubChem CID 173084883) has the molecular formula C10H19As and a molecular weight of 214.18 g/mol. Its IUPAC name is dec-1-ynylarsane.

Molecular Properties

Compound Namedec-1-ynylarsane
PubChem CID173084883
Molecular FormulaC10H19As
Molecular Weight214.18 g/mol
Exact Mass214.07
IUPAC Namedec-1-ynylarsane
SMILESCCCCCCCCC#C[AsH2]
InChIInChI=1S/C10H19As/c1-2-3-4-5-6-7-8-9-10-11/h2-8,11H2,1H3
InChIKeyRURRZPQZNCNCIZ-UHFFFAOYSA-N
XLogP2.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.18
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dec-1-ynylarsane?
The IUPAC name of dec-1-ynylarsane (CID 173084883) is dec-1-ynylarsane.
What is the SMILES notation for dec-1-ynylarsane?
The canonical SMILES for dec-1-ynylarsane is CCCCCCCCC#C[AsH2].
What is the InChIKey of dec-1-ynylarsane?
The InChIKey is RURRZPQZNCNCIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19As/c1-2-3-4-5-6-7-8-9-10-11/h2-8,11H2,1H3.
What are the key properties of dec-1-ynylarsane?
dec-1-ynylarsane has a molecular weight of 214.18 g/mol, XLogP of 2.33, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dec-1-ynylarsane is sourced from PubChem (CID 173084883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).