2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol

C10H11ClO3 — CID 71328780

IUPAC2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol
SMILESCC1(c2ccc(Cl)c(O)c2)OCCO1
InChIInChI=1S/C10H11ClO3/c1-10(13-4-5-14-10)7-2-3-8(11)9(12)6-7/h2-3,6,12H,4-5H2,1H3
InChIKeyIRIFICVAFVJRHQ-UHFFFAOYSA-N
MW214.65 g/mol
LogP2.27
Rot. Bonds1

About 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol

2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol (PubChem CID 71328780) has the molecular formula C10H11ClO3 and a molecular weight of 214.65 g/mol. Its IUPAC name is 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol.

Molecular Properties

Compound Name2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol
PubChem CID71328780
Molecular FormulaC10H11ClO3
Molecular Weight214.65 g/mol
Exact Mass214.04
IUPAC Name2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol
SMILESCC1(c2ccc(Cl)c(O)c2)OCCO1
InChIInChI=1S/C10H11ClO3/c1-10(13-4-5-14-10)7-2-3-8(11)9(12)6-7/h2-3,6,12H,4-5H2,1H3
InChIKeyIRIFICVAFVJRHQ-UHFFFAOYSA-N
XLogP2.27
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol?
The IUPAC name of 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol (CID 71328780) is 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol.
What is the SMILES notation for 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol?
The canonical SMILES for 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol is CC1(c2ccc(Cl)c(O)c2)OCCO1.
What is the InChIKey of 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol?
The InChIKey is IRIFICVAFVJRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO3/c1-10(13-4-5-14-10)7-2-3-8(11)9(12)6-7/h2-3,6,12H,4-5H2,1H3.
What are the key properties of 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol?
2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol has a molecular weight of 214.65 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2-methyl-1,3-dioxolan-2-yl)phenol is sourced from PubChem (CID 71328780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).