acetylene;ethane;propane

C16H38 — CID 142048360

IUPACacetylene;ethane;propane
SMILESC#C.C#C.CC.CC.CC.CCC.CCC
InChIInChI=1S/2C3H8.3C2H6.2C2H2/c2*1-3-2;5*1-2/h2*3H2,1-2H3;3*1-2H3;2*1-2H
InChIKeyQYGANOOLVXGYOZ-UHFFFAOYSA-N
MW230.48 g/mol
LogP6.41
Rot. Bonds

About acetylene;ethane;propane

acetylene;ethane;propane (PubChem CID 142048360) has the molecular formula C16H38 and a molecular weight of 230.48 g/mol. Its IUPAC name is acetylene;ethane;propane.

Molecular Properties

Compound Nameacetylene;ethane;propane
PubChem CID142048360
Molecular FormulaC16H38
Molecular Weight230.48 g/mol
Exact Mass230.30
IUPAC Nameacetylene;ethane;propane
SMILESC#C.C#C.CC.CC.CC.CCC.CCC
InChIInChI=1S/2C3H8.3C2H6.2C2H2/c2*1-3-2;5*1-2/h2*3H2,1-2H3;3*1-2H3;2*1-2H
InChIKeyQYGANOOLVXGYOZ-UHFFFAOYSA-N
XLogP6.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500230.48
LogP ≤ 56.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Bis(tributylstannyl)acetylene
CID 305981
Tributyl(2-tributylstannylvinyl)stannane
CID 101608709
CID 173369081
CID 173369081
Tributyl(2-trimethylstannylethynyl)stannane
CID 13118908
Acetylene;prop-1-yne
CID 18962725
Butane;ethane
CID 90704397
CID 91117258
CID 91117258
Ethane;propane
CID 91375565
Butane;ethane;propane
CID 141769463
Acetylene;ethane;propane
CID 141769522
Acetylene;butane;ethane
CID 141769524
Acetylene;ethane;pentane
CID 141769525

Frequently Asked Questions

What is the IUPAC name of acetylene;ethane;propane?
The IUPAC name of acetylene;ethane;propane (CID 142048360) is acetylene;ethane;propane.
What is the SMILES notation for acetylene;ethane;propane?
The canonical SMILES for acetylene;ethane;propane is C#C.C#C.CC.CC.CC.CCC.CCC.
What is the InChIKey of acetylene;ethane;propane?
The InChIKey is QYGANOOLVXGYOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H8.3C2H6.2C2H2/c2*1-3-2;5*1-2/h2*3H2,1-2H3;3*1-2H3;2*1-2H.
What are the key properties of acetylene;ethane;propane?
acetylene;ethane;propane has a molecular weight of 230.48 g/mol, XLogP of 6.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for acetylene;ethane;propane is sourced from PubChem (CID 142048360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).