CID 87257493

C8H16AlBr — CID 87257493

IUPAC—
SMILESBr.[Al]C1CCCCCCC1
InChIInChI=1S/C8H15.Al.BrH/c1-2-4-6-8-7-5-3-1;;/h1H,2-8H2;;1H
InChIKeyDBUHKNPLRCZRCL-UHFFFAOYSA-N
MW219.10 g/mol
LogP3.27
Rot. Bonds

About CID 87257493

CID 87257493 (PubChem CID 87257493) has the molecular formula C8H16AlBr and a molecular weight of 219.10 g/mol.

Molecular Properties

Compound NameCID 87257493
PubChem CID87257493
Molecular FormulaC8H16AlBr
Molecular Weight219.10 g/mol
Exact Mass218.03
IUPAC Name—
SMILESBr.[Al]C1CCCCCCC1
InChIInChI=1S/C8H15.Al.BrH/c1-2-4-6-8-7-5-3-1;;/h1H,2-8H2;;1H
InChIKeyDBUHKNPLRCZRCL-UHFFFAOYSA-N
XLogP3.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.10
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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tris(cyclopentadecane);hydrobromide
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(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
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cyclohexylcycloheptane
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cyclononylcycloicosane
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CID 173106784
CID 173106784
bicyclo[112.2.2]octadecahectane
CID 91239791
bicyclo[5.5.3]pentadecane
CID 59938678
1,2,3,3a,4,5,6,7,8,9,10,10a-dodecahydrocyclopenta[9]annulene
CID 58552309
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane;cyclopropane
CID 158726060
azane;cyclohexylcyclohexane
CID 66583255
bicyclo[4.4.2]dodecane;cyclooctane
CID 158063107

Frequently Asked Questions

What is the IUPAC name of CID 87257493?
The IUPAC name of CID 87257493 (CID 87257493) is not available.
What is the SMILES notation for CID 87257493?
The canonical SMILES for CID 87257493 is Br.[Al]C1CCCCCCC1.
What is the InChIKey of CID 87257493?
The InChIKey is DBUHKNPLRCZRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15.Al.BrH/c1-2-4-6-8-7-5-3-1;;/h1H,2-8H2;;1H.
What are the key properties of CID 87257493?
CID 87257493 has a molecular weight of 219.10 g/mol, XLogP of 3.27, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87257493 is sourced from PubChem (CID 87257493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).