(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane

C10H15Br — CID 14268506

IUPAC(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane
SMILESBrC1[C@@]23CCCC[C@@]12CCC3
InChIInChI=1S/C10H15Br/c11-8-9-4-1-2-5-10(8,9)7-3-6-9/h8H,1-7H2/t8?,9-,10+
InChIKeyVUZSYTXUAFIMAR-PBINXNQUSA-N
MW215.13 g/mol
LogP3.49
Rot. Bonds

About (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane

(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane (PubChem CID 14268506) has the molecular formula C10H15Br and a molecular weight of 215.13 g/mol. Its IUPAC name is (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane.

Molecular Properties

Compound Name(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane
PubChem CID14268506
Molecular FormulaC10H15Br
Molecular Weight215.13 g/mol
Exact Mass214.04
IUPAC Name(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane
SMILESBrC1[C@@]23CCCC[C@@]12CCC3
InChIInChI=1S/C10H15Br/c11-8-9-4-1-2-5-10(8,9)7-3-6-9/h8H,1-7H2/t8?,9-,10+
InChIKeyVUZSYTXUAFIMAR-PBINXNQUSA-N
XLogP3.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.13
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane?
The IUPAC name of (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane (CID 14268506) is (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane.
What is the SMILES notation for (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane?
The canonical SMILES for (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane is BrC1[C@@]23CCCC[C@@]12CCC3.
What is the InChIKey of (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane?
The InChIKey is VUZSYTXUAFIMAR-PBINXNQUSA-N. The full InChI is InChI=1S/C10H15Br/c11-8-9-4-1-2-5-10(8,9)7-3-6-9/h8H,1-7H2/t8?,9-,10+.
What are the key properties of (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane?
(1R,6S)-10-bromotricyclo[4.3.1.01,6]decane has a molecular weight of 215.13 g/mol, XLogP of 3.49, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,6S)-10-bromotricyclo[4.3.1.01,6]decane is sourced from PubChem (CID 14268506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).