(1-methoxycyclohexyl)-phenylmethanol

C14H20O2 — CID 116753267

IUPAC(1-methoxycyclohexyl)-phenylmethanol
SMILESCOC1(C(O)c2ccccc2)CCCCC1
InChIInChI=1S/C14H20O2/c1-16-14(10-6-3-7-11-14)13(15)12-8-4-2-5-9-12/h2,4-5,8-9,13,15H,3,6-7,10-11H2,1H3
InChIKeyMYLUCNMROHRQPT-UHFFFAOYSA-N
MW220.31 g/mol
LogP3.07
Rot. Bonds3

About (1-methoxycyclohexyl)-phenylmethanol

(1-methoxycyclohexyl)-phenylmethanol (PubChem CID 116753267) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is (1-methoxycyclohexyl)-phenylmethanol.

Molecular Properties

Compound Name(1-methoxycyclohexyl)-phenylmethanol
PubChem CID116753267
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name(1-methoxycyclohexyl)-phenylmethanol
SMILESCOC1(C(O)c2ccccc2)CCCCC1
InChIInChI=1S/C14H20O2/c1-16-14(10-6-3-7-11-14)13(15)12-8-4-2-5-9-12/h2,4-5,8-9,13,15H,3,6-7,10-11H2,1H3
InChIKeyMYLUCNMROHRQPT-UHFFFAOYSA-N
XLogP3.07
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclohexyl)-phenylmethanol?
The IUPAC name of (1-methoxycyclohexyl)-phenylmethanol (CID 116753267) is (1-methoxycyclohexyl)-phenylmethanol.
What is the SMILES notation for (1-methoxycyclohexyl)-phenylmethanol?
The canonical SMILES for (1-methoxycyclohexyl)-phenylmethanol is COC1(C(O)c2ccccc2)CCCCC1.
What is the InChIKey of (1-methoxycyclohexyl)-phenylmethanol?
The InChIKey is MYLUCNMROHRQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-16-14(10-6-3-7-11-14)13(15)12-8-4-2-5-9-12/h2,4-5,8-9,13,15H,3,6-7,10-11H2,1H3.
What are the key properties of (1-methoxycyclohexyl)-phenylmethanol?
(1-methoxycyclohexyl)-phenylmethanol has a molecular weight of 220.31 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclohexyl)-phenylmethanol is sourced from PubChem (CID 116753267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).