methane;1,3-xylene;1,4-xylene

C20H36 — CID 161051420

IUPACmethane;1,3-xylene;1,4-xylene
SMILESC.C.C.C.Cc1ccc(C)cc1.Cc1cccc(C)c1
InChIInChI=1S/2C8H10.4CH4/c1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;;;;/h2*3-6H,1-2H3;4*1H4
InChIKeyUCEOIXWYACVOMN-UHFFFAOYSA-N
MW276.51 g/mol
LogP7.15
Rot. Bonds

About methane;1,3-xylene;1,4-xylene

methane;1,3-xylene;1,4-xylene (PubChem CID 161051420) has the molecular formula C20H36 and a molecular weight of 276.51 g/mol. Its IUPAC name is methane;1,3-xylene;1,4-xylene.

Molecular Properties

Compound Namemethane;1,3-xylene;1,4-xylene
PubChem CID161051420
Molecular FormulaC20H36
Molecular Weight276.51 g/mol
Exact Mass276.28
IUPAC Namemethane;1,3-xylene;1,4-xylene
SMILESC.C.C.C.Cc1ccc(C)cc1.Cc1cccc(C)c1
InChIInChI=1S/2C8H10.4CH4/c1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;;;;/h2*3-6H,1-2H3;4*1H4
InChIKeyUCEOIXWYACVOMN-UHFFFAOYSA-N
XLogP7.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.51
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;1,3-xylene;1,4-xylene
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CID 67351774
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argon;1,3-xylene
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uranium;1,3-xylene
CID 142096795
methane;1-methyl-3-(4-methylphenyl)benzene
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azane;1,3-xylene;hydrochloride
CID 175000695
1-methyl-4-(4-methylphenoxy)benzene;1,3-xylene;1,4-xylene
CID 159470463
1,2,4,5-tetramethylbenzene;1,2-xylene;1,3-xylene;1,4-xylene
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Frequently Asked Questions

What is the IUPAC name of methane;1,3-xylene;1,4-xylene?
The IUPAC name of methane;1,3-xylene;1,4-xylene (CID 161051420) is methane;1,3-xylene;1,4-xylene.
What is the SMILES notation for methane;1,3-xylene;1,4-xylene?
The canonical SMILES for methane;1,3-xylene;1,4-xylene is C.C.C.C.Cc1ccc(C)cc1.Cc1cccc(C)c1.
What is the InChIKey of methane;1,3-xylene;1,4-xylene?
The InChIKey is UCEOIXWYACVOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H10.4CH4/c1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;;;;/h2*3-6H,1-2H3;4*1H4.
What are the key properties of methane;1,3-xylene;1,4-xylene?
methane;1,3-xylene;1,4-xylene has a molecular weight of 276.51 g/mol, XLogP of 7.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1,3-xylene;1,4-xylene is sourced from PubChem (CID 161051420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).