[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol

C10H17ClO2 — CID 106825174

IUPAC[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol
SMILESC=C(Cl)COC1CCC(CO)CC1
InChIInChI=1S/C10H17ClO2/c1-8(11)7-13-10-4-2-9(6-12)3-5-10/h9-10,12H,1-7H2
InChIKeyIECWEYSSUAUEDY-UHFFFAOYSA-N
MW204.70 g/mol
LogP2.31
Rot. Bonds4

About [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol

[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol (PubChem CID 106825174) has the molecular formula C10H17ClO2 and a molecular weight of 204.70 g/mol. Its IUPAC name is [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol
PubChem CID106825174
Molecular FormulaC10H17ClO2
Molecular Weight204.70 g/mol
Exact Mass204.09
IUPAC Name[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol
SMILESC=C(Cl)COC1CCC(CO)CC1
InChIInChI=1S/C10H17ClO2/c1-8(11)7-13-10-4-2-9(6-12)3-5-10/h9-10,12H,1-7H2
InChIKeyIECWEYSSUAUEDY-UHFFFAOYSA-N
XLogP2.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.70
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol?
The IUPAC name of [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol (CID 106825174) is [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol.
What is the SMILES notation for [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol?
The canonical SMILES for [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol is C=C(Cl)COC1CCC(CO)CC1.
What is the InChIKey of [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol?
The InChIKey is IECWEYSSUAUEDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClO2/c1-8(11)7-13-10-4-2-9(6-12)3-5-10/h9-10,12H,1-7H2.
What are the key properties of [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol?
[4-(2-chloroprop-2-enoxy)cyclohexyl]methanol has a molecular weight of 204.70 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-chloroprop-2-enoxy)cyclohexyl]methanol is sourced from PubChem (CID 106825174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).