6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene

C13H17Cl — CID 82255501

IUPAC6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(Cl)Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C13H17Cl/c1-10(14)8-11-6-7-12-4-2-3-5-13(12)9-11/h6-7,9-10H,2-5,8H2,1H3
InChIKeyIJWCWENIPXJJIS-UHFFFAOYSA-N
MW208.73 g/mol
LogP3.74
Rot. Bonds2

About 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene

6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 82255501) has the molecular formula C13H17Cl and a molecular weight of 208.73 g/mol. Its IUPAC name is 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID82255501
Molecular FormulaC13H17Cl
Molecular Weight208.73 g/mol
Exact Mass208.10
IUPAC Name6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(Cl)Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C13H17Cl/c1-10(14)8-11-6-7-12-4-2-3-5-13(12)9-11/h6-7,9-10H,2-5,8H2,1H3
InChIKeyIJWCWENIPXJJIS-UHFFFAOYSA-N
XLogP3.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.73
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

5-(3-chloro-2-methylpropyl)-2,3-dihydro-1H-indene
CID 66034063
5-[2-(chloromethyl)-4-methylpentyl]-2,3-dihydro-1H-indene
CID 66033857
N-propan-2-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine
CID 82262476
5-[chloro-[4-(2-methylpropyl)phenyl]methyl]-2,3-dihydro-1H-indene
CID 63430886
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-2-amine
CID 43163778
2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-yl]propane-1,3-diamine
CID 83931724
4-methyl-9-(2-methylpropyl)-1,2,3,5,6,7-hexahydro-4-benzazonine
CID 170264130
[1-(2,3-dihydro-1H-inden-5-yl)-3,4-dimethylpentan-2-yl]hydrazine
CID 105310742
1-(2,3-dihydro-1H-inden-5-yl)-N-ethenyl-N-methylpropan-2-amine
CID 167310084
6-[1-chloro-2-(3,4-dimethylphenyl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 63431085
[1-(2,3-dihydro-1H-inden-5-yl)-5-methylhexan-2-yl]hydrazine
CID 105207475
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-yl]cyclopropanamine
CID 82262583

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene (CID 82255501) is 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene is CC(Cl)Cc1ccc2c(c1)CCCC2.
What is the InChIKey of 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is IJWCWENIPXJJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17Cl/c1-10(14)8-11-6-7-12-4-2-3-5-13(12)9-11/h6-7,9-10H,2-5,8H2,1H3.
What are the key properties of 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene?
6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 208.73 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 82255501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).