methane;propane;1,4-xylene

C25H62 — CID 160778309

IUPACmethane;propane;1,4-xylene
SMILESC.C.C.C.C.CCC.CCC.CCC.CCC.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.4C3H8.5CH4/c1-7-3-5-8(2)6-4-7;4*1-3-2;;;;;/h3-6H,1-2H3;4*3H2,1-2H3;5*1H4
InChIKeySAFYSPBCBQMUQN-UHFFFAOYSA-N
MW362.77 g/mol
LogP11.15
Rot. Bonds

About methane;propane;1,4-xylene

methane;propane;1,4-xylene (PubChem CID 160778309) has the molecular formula C25H62 and a molecular weight of 362.77 g/mol. Its IUPAC name is methane;propane;1,4-xylene.

Molecular Properties

Compound Namemethane;propane;1,4-xylene
PubChem CID160778309
Molecular FormulaC25H62
Molecular Weight362.77 g/mol
Exact Mass362.49
IUPAC Namemethane;propane;1,4-xylene
SMILESC.C.C.C.C.CCC.CCC.CCC.CCC.Cc1ccc(C)cc1
InChIInChI=1S/C8H10.4C3H8.5CH4/c1-7-3-5-8(2)6-4-7;4*1-3-2;;;;;/h3-6H,1-2H3;4*3H2,1-2H3;5*1H4
InChIKeySAFYSPBCBQMUQN-UHFFFAOYSA-N
XLogP11.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.77
LogP ≤ 511.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

methane;propane;1,4-xylene
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CID 144580802
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CID 91364516
benzene;propane;toluene
CID 91053661
propane;toluene
CID 91263172
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CID 70196397
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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 160778309) 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.C.C.C.CCC.CCC.CCC.CCC.Cc1ccc(C)cc1.
What is the InChIKey of methane;propane;1,4-xylene?
The InChIKey is SAFYSPBCBQMUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.4C3H8.5CH4/c1-7-3-5-8(2)6-4-7;4*1-3-2;;;;;/h3-6H,1-2H3;4*3H2,1-2H3;5*1H4.
What are the key properties of methane;propane;1,4-xylene?
methane;propane;1,4-xylene has a molecular weight of 362.77 g/mol, XLogP of 11.15, 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 160778309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).