10-bromo-10,10-dideuteriodec-1-ene

C10H19Br — CID 10846609

IUPAC10-bromo-10,10-dideuteriodec-1-ene
SMILES[2H]C([2H])(Br)CCCCCCCC=C
InChIInChI=1S/C10H19Br/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/i10D2
InChIKeyJVVPJOMYWVYPOF-KBMKNGFXSA-N
MW221.18 g/mol
LogP4.30
Rot. Bonds8

About 10-bromo-10,10-dideuteriodec-1-ene

10-bromo-10,10-dideuteriodec-1-ene (PubChem CID 10846609) has the molecular formula C10H19Br and a molecular weight of 221.18 g/mol. Its IUPAC name is 10-bromo-10,10-dideuteriodec-1-ene.

Molecular Properties

Compound Name10-bromo-10,10-dideuteriodec-1-ene
PubChem CID10846609
Molecular FormulaC10H19Br
Molecular Weight221.18 g/mol
Exact Mass220.08
IUPAC Name10-bromo-10,10-dideuteriodec-1-ene
SMILES[2H]C([2H])(Br)CCCCCCCC=C
InChIInChI=1S/C10H19Br/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/i10D2
InChIKeyJVVPJOMYWVYPOF-KBMKNGFXSA-N
XLogP4.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.18
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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heptahexaconta-1,23,66-triene
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1-bromooct-7-en-2-ol
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CID 86210796
11-bromohenicosa-1,20-diene
CID 102253799
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CID 155683254
dibromo(non-8-enyl)silane
CID 173300687
heptadec-16-en-1-amine
CID 15590771
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706
octadeca-1,17-diene;tetradec-1-ene
CID 173070986

Frequently Asked Questions

What is the IUPAC name of 10-bromo-10,10-dideuteriodec-1-ene?
The IUPAC name of 10-bromo-10,10-dideuteriodec-1-ene (CID 10846609) is 10-bromo-10,10-dideuteriodec-1-ene.
What is the SMILES notation for 10-bromo-10,10-dideuteriodec-1-ene?
The canonical SMILES for 10-bromo-10,10-dideuteriodec-1-ene is [2H]C([2H])(Br)CCCCCCCC=C.
What is the InChIKey of 10-bromo-10,10-dideuteriodec-1-ene?
The InChIKey is JVVPJOMYWVYPOF-KBMKNGFXSA-N. The full InChI is InChI=1S/C10H19Br/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/i10D2.
What are the key properties of 10-bromo-10,10-dideuteriodec-1-ene?
10-bromo-10,10-dideuteriodec-1-ene has a molecular weight of 221.18 g/mol, XLogP of 4.30, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-bromo-10,10-dideuteriodec-1-ene is sourced from PubChem (CID 10846609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).