4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene

C15H26O — CID 159051573

IUPAC4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene
SMILESCC1CCC(O)CC1.Cc1ccc(C)cc1.[H][H]
InChIInChI=1S/C8H10.C7H14O.H2/c1-7-3-5-8(2)6-4-7;1-6-2-4-7(8)5-3-6;/h3-6H,1-2H3;6-8H,2-5H2,1H3;1H
InChIKeyJXIGCDUKZSEJAR-UHFFFAOYSA-N
MW222.37 g/mol
LogP4.11
Rot. Bonds

About 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene

4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene (PubChem CID 159051573) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene.

Molecular Properties

Compound Name4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene
PubChem CID159051573
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene
SMILESCC1CCC(O)CC1.Cc1ccc(C)cc1.[H][H]
InChIInChI=1S/C8H10.C7H14O.H2/c1-7-3-5-8(2)6-4-7;1-6-2-4-7(8)5-3-6;/h3-6H,1-2H3;6-8H,2-5H2,1H3;1H
InChIKeyJXIGCDUKZSEJAR-UHFFFAOYSA-N
XLogP4.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

tetrakis(1,4-dimethylcyclohexane);methane;molecular hydrogen;bis(1,4-xylene)
CID 160768491
tetrakis(1,4-dimethylcyclohexane);methane;1,4-xylene
CID 158719063
4-methylcyclohexan-1-ol
CID 11524
(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;molecular hydrogen
CID 160876480
4-(N,4-dimethylanilino)cyclohexan-1-ol
CID 114762541
4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
CID 116941804
1-methyl-4-[4-[4-(4-methylcyclohexyl)cyclohexyl]cyclohexyl]benzene
CID 20580006
1-methyl-4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;molecular hydrogen
CID 159699937
tetrakis(1,4-dimethylcyclohexane);methane;molecular hydrogen
CID 160864488
tetrakis(1,3-difluoro-2,5-dimethylbenzene);1,4-dimethylcyclohexane;tetrakis(2-fluoro-1,4-dimethylbenzene);methane;molecular hydrogen;bis(1,4-xylene)
CID 162180141
bis(1,4-dimethylcyclohexane);bis(2-fluoro-1,4-dimethylbenzene);1,4-xylene
CID 159175057
acetonitrile;ethane;4-methylcyclohexan-1-ol
CID 142088226

Frequently Asked Questions

What is the IUPAC name of 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene?
The IUPAC name of 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene (CID 159051573) is 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene.
What is the SMILES notation for 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene?
The canonical SMILES for 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene is CC1CCC(O)CC1.Cc1ccc(C)cc1.[H][H].
What is the InChIKey of 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene?
The InChIKey is JXIGCDUKZSEJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.C7H14O.H2/c1-7-3-5-8(2)6-4-7;1-6-2-4-7(8)5-3-6;/h3-6H,1-2H3;6-8H,2-5H2,1H3;1H.
What are the key properties of 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene?
4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene has a molecular weight of 222.37 g/mol, XLogP of 4.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylcyclohexan-1-ol;molecular hydrogen;1,4-xylene is sourced from PubChem (CID 159051573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).