6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]

C15H19Br — CID 83826155

IUPAC6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]
SMILESBrc1ccc2c(c1)C1(CCCCC1)CCC2
InChIInChI=1S/C15H19Br/c16-13-7-6-12-5-4-10-15(14(12)11-13)8-2-1-3-9-15/h6-7,11H,1-5,8-10H2
InChIKeyQNSGQDJAOKEFNO-UHFFFAOYSA-N
MW279.22 g/mol
LogP4.99
Rot. Bonds

About 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]

6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane] (PubChem CID 83826155) has the molecular formula C15H19Br and a molecular weight of 279.22 g/mol. Its IUPAC name is 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane].

Molecular Properties

Compound Name6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]
PubChem CID83826155
Molecular FormulaC15H19Br
Molecular Weight279.22 g/mol
Exact Mass278.07
IUPAC Name6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]
SMILESBrc1ccc2c(c1)C1(CCCCC1)CCC2
InChIInChI=1S/C15H19Br/c16-13-7-6-12-5-4-10-15(14(12)11-13)8-2-1-3-9-15/h6-7,11H,1-5,8-10H2
InChIKeyQNSGQDJAOKEFNO-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]?
The IUPAC name of 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane] (CID 83826155) is 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane].
What is the SMILES notation for 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]?
The canonical SMILES for 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane] is Brc1ccc2c(c1)C1(CCCCC1)CCC2.
What is the InChIKey of 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]?
The InChIKey is QNSGQDJAOKEFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Br/c16-13-7-6-12-5-4-10-15(14(12)11-13)8-2-1-3-9-15/h6-7,11H,1-5,8-10H2.
What are the key properties of 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane]?
6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane] has a molecular weight of 279.22 g/mol, XLogP of 4.99, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromospiro[2,3-dihydro-1H-naphthalene-4,1'-cyclohexane] is sourced from PubChem (CID 83826155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).