1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene

C12H15ClO — CID 43135615

IUPAC1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
SMILESClCCOC1CCCc2ccccc21
InChIInChI=1S/C12H15ClO/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12H,3,5,7-9H2
InChIKeyKRVLJUHHSPOJSR-UHFFFAOYSA-N
MW210.70 g/mol
LogP3.32
Rot. Bonds3

About 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene

1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene (PubChem CID 43135615) has the molecular formula C12H15ClO and a molecular weight of 210.70 g/mol. Its IUPAC name is 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
PubChem CID43135615
Molecular FormulaC12H15ClO
Molecular Weight210.70 g/mol
Exact Mass210.08
IUPAC Name1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene
SMILESClCCOC1CCCc2ccccc21
InChIInChI=1S/C12H15ClO/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12H,3,5,7-9H2
InChIKeyKRVLJUHHSPOJSR-UHFFFAOYSA-N
XLogP3.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.70
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]aniline
CID 62497436
N-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethanamine;hydrochloride
CID 67867639
4-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]aniline
CID 43519719
1-amino-4-(1,2,3,4-tetrahydronaphthalen-1-yloxy)butan-2-ol
CID 64814404
N-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)ethyl]butan-2-amine
CID 62571109
4-(chloromethyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yloxymethyl)-1,3-thiazole
CID 43138207
2-(methylamino)-4-(1,2,3,4-tetrahydronaphthalen-1-yloxy)butanenitrile
CID 63027618
N-(2-methylpropyl)-5-(1,2,3,4-tetrahydronaphthalen-1-yloxy)pentan-1-amine
CID 62455421
1-(2,3-dihydro-1H-inden-1-yloxymethoxy)-2,3-dihydro-1H-indene
CID 70037925
2-amino-3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)propan-1-ol
CID 64803202
2-amino-N-[3-(1,2,3,4-tetrahydronaphthalen-1-yloxy)propyl]acetamide;hydrochloride
CID 119325756
N'-hydroxy-2,2-dimethyl-4-(1,2,3,4-tetrahydronaphthalen-1-yloxy)butanimidamide
CID 77062747

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene (CID 43135615) is 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene is ClCCOC1CCCc2ccccc21.
What is the InChIKey of 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is KRVLJUHHSPOJSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClO/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12H,3,5,7-9H2.
What are the key properties of 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene?
1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 210.70 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloroethoxy)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 43135615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).