2-chloro-5-(phenoxymethyl)thiophene

C11H9ClOS — CID 60655556

IUPAC2-chloro-5-(phenoxymethyl)thiophene
SMILESClc1ccc(COc2ccccc2)s1
InChIInChI=1S/C11H9ClOS/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7H,8H2
InChIKeyVQHBUWGNIIFALG-UHFFFAOYSA-N
MW224.71 g/mol
LogP3.98
Rot. Bonds3

About 2-chloro-5-(phenoxymethyl)thiophene

2-chloro-5-(phenoxymethyl)thiophene (PubChem CID 60655556) has the molecular formula C11H9ClOS and a molecular weight of 224.71 g/mol. Its IUPAC name is 2-chloro-5-(phenoxymethyl)thiophene.

Molecular Properties

Compound Name2-chloro-5-(phenoxymethyl)thiophene
PubChem CID60655556
Molecular FormulaC11H9ClOS
Molecular Weight224.71 g/mol
Exact Mass224.01
IUPAC Name2-chloro-5-(phenoxymethyl)thiophene
SMILESClc1ccc(COc2ccccc2)s1
InChIInChI=1S/C11H9ClOS/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7H,8H2
InChIKeyVQHBUWGNIIFALG-UHFFFAOYSA-N
XLogP3.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.71
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-[(5-chlorothiophen-2-yl)methoxy]benzoate
CID 55372452
3-[(5-chlorothiophen-2-yl)methoxy]-5-methoxybenzonitrile
CID 103566952
[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine
CID 60887305
4-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-amine
CID 63691859
3-[(5-chlorothiophen-2-yl)methoxy]pyridin-2-amine
CID 43125741
2,5-bis(phenoxymethyl)-1,3-thiazole
CID 90704535
[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanol
CID 43505734
(2S)-2-[(5-chlorothiophen-2-yl)methoxy]propanoic acid
CID 104876424
4,5-dichloro-2-[(5-chlorothiophen-2-yl)methoxy]aniline
CID 107498892
2-[(5-chlorothiophen-2-yl)methoxy]isoindole-1,3-dione
CID 67270650
5-[(4-chlorophenoxy)methyl]thiophene-2-carboxylic acid
CID 19620512
2-[(5-chlorothiophen-2-yl)methoxy]-6-(trifluoromethyl)pyridine
CID 75427115

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(phenoxymethyl)thiophene?
The IUPAC name of 2-chloro-5-(phenoxymethyl)thiophene (CID 60655556) is 2-chloro-5-(phenoxymethyl)thiophene.
What is the SMILES notation for 2-chloro-5-(phenoxymethyl)thiophene?
The canonical SMILES for 2-chloro-5-(phenoxymethyl)thiophene is Clc1ccc(COc2ccccc2)s1.
What is the InChIKey of 2-chloro-5-(phenoxymethyl)thiophene?
The InChIKey is VQHBUWGNIIFALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClOS/c12-11-7-6-10(14-11)8-13-9-4-2-1-3-5-9/h1-7H,8H2.
What are the key properties of 2-chloro-5-(phenoxymethyl)thiophene?
2-chloro-5-(phenoxymethyl)thiophene has a molecular weight of 224.71 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(phenoxymethyl)thiophene is sourced from PubChem (CID 60655556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).