methane;propane;1,4-xylene

C13H26 — CID 143560264

IUPACmethane;propane;1,4-xylene
SMILESC.C.CCC.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C3H8.2CH4/c1-7-3-5-8(2)6-4-7;1-3-2;;/h3-6H,1-2H3;3H2,1-2H3;2*1H4
InChIKeyBGBRAICKLSCASU-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.99
Rot. Bonds

About methane;propane;1,4-xylene

methane;propane;1,4-xylene (PubChem CID 143560264) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is methane;propane;1,4-xylene.

Molecular Properties

Compound Namemethane;propane;1,4-xylene
PubChem CID143560264
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Namemethane;propane;1,4-xylene
SMILESC.C.CCC.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.C3H8.2CH4/c1-7-3-5-8(2)6-4-7;1-3-2;;/h3-6H,1-2H3;3H2,1-2H3;2*1H4
InChIKeyBGBRAICKLSCASU-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 91364516
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CID 91263172
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Frequently Asked Questions

What is the IUPAC name of methane;propane;1,4-xylene?
The IUPAC name of methane;propane;1,4-xylene (CID 143560264) is methane;propane;1,4-xylene.
What is the SMILES notation for methane;propane;1,4-xylene?
The canonical SMILES for methane;propane;1,4-xylene is C.C.CCC.Cc1ccc(C)cc1.
What is the InChIKey of methane;propane;1,4-xylene?
The InChIKey is BGBRAICKLSCASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.C3H8.2CH4/c1-7-3-5-8(2)6-4-7;1-3-2;;/h3-6H,1-2H3;3H2,1-2H3;2*1H4.
What are the key properties of methane;propane;1,4-xylene?
methane;propane;1,4-xylene has a molecular weight of 182.35 g/mol, XLogP of 4.99, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;propane;1,4-xylene is sourced from PubChem (CID 143560264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).