(2-chlorophenyl)-(oxolan-3-yl)methanol

C11H13ClO2 — CID 63564171

IUPAC(2-chlorophenyl)-(oxolan-3-yl)methanol
SMILESOC(c1ccccc1Cl)C1CCOC1
InChIInChI=1S/C11H13ClO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2
InChIKeyWQGOSHVLDXHFOR-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.41
Rot. Bonds2

About (2-chlorophenyl)-(oxolan-3-yl)methanol

(2-chlorophenyl)-(oxolan-3-yl)methanol (PubChem CID 63564171) has the molecular formula C11H13ClO2 and a molecular weight of 212.68 g/mol. Its IUPAC name is (2-chlorophenyl)-(oxolan-3-yl)methanol.

Molecular Properties

Compound Name(2-chlorophenyl)-(oxolan-3-yl)methanol
PubChem CID63564171
Molecular FormulaC11H13ClO2
Molecular Weight212.68 g/mol
Exact Mass212.06
IUPAC Name(2-chlorophenyl)-(oxolan-3-yl)methanol
SMILESOC(c1ccccc1Cl)C1CCOC1
InChIInChI=1S/C11H13ClO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2
InChIKeyWQGOSHVLDXHFOR-UHFFFAOYSA-N
XLogP2.41
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluorophenyl)-(oxolan-3-yl)methanol
CID 63565123
(R)-(2-chlorophenyl)-cyclopentylmethanol
CID 93462160
(3-chloro-2-fluorophenyl)-(oxan-4-yl)methanol
CID 64713264
(2-chloro-4-fluorophenyl)-(oxan-3-yl)methanol
CID 107136089
(2-methylfuran-3-yl)-(oxolan-3-yl)methanol
CID 104789574
(2,5-dichlorophenyl)-(oxan-3-yl)methanol
CID 63013314
(3-chloro-4-pyridinyl)-(oxan-3-yl)methanol
CID 107139487
(3,5-dichlorophenyl)-(oxolan-3-yl)methanol
CID 63899921
(4-chloro-2-methoxyphenyl)-(oxolan-3-yl)methanol
CID 115798171
(2,5-dibromophenyl)-(oxolan-3-yl)methanol
CID 61277086
oxolan-3-yl-(2,3,4-trifluorophenyl)methanol
CID 63893972
(2-chlorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanol
CID 112680913

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(oxolan-3-yl)methanol?
The IUPAC name of (2-chlorophenyl)-(oxolan-3-yl)methanol (CID 63564171) is (2-chlorophenyl)-(oxolan-3-yl)methanol.
What is the SMILES notation for (2-chlorophenyl)-(oxolan-3-yl)methanol?
The canonical SMILES for (2-chlorophenyl)-(oxolan-3-yl)methanol is OC(c1ccccc1Cl)C1CCOC1.
What is the InChIKey of (2-chlorophenyl)-(oxolan-3-yl)methanol?
The InChIKey is WQGOSHVLDXHFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClO2/c12-10-4-2-1-3-9(10)11(13)8-5-6-14-7-8/h1-4,8,11,13H,5-7H2.
What are the key properties of (2-chlorophenyl)-(oxolan-3-yl)methanol?
(2-chlorophenyl)-(oxolan-3-yl)methanol has a molecular weight of 212.68 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(oxolan-3-yl)methanol is sourced from PubChem (CID 63564171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).