8-bromononan-1-ol

C9H19BrO — CID 18177005

IUPAC8-bromononan-1-ol
SMILESCC(Br)CCCCCCCO
InChIInChI=1S/C9H19BrO/c1-9(10)7-5-3-2-4-6-8-11/h9,11H,2-8H2,1H3
InChIKeyFAKIVYWHXMZKOQ-UHFFFAOYSA-N
MW223.15 g/mol
LogP3.10
Rot. Bonds7

About 8-bromononan-1-ol

8-bromononan-1-ol (PubChem CID 18177005) has the molecular formula C9H19BrO and a molecular weight of 223.15 g/mol. Its IUPAC name is 8-bromononan-1-ol.

Molecular Properties

Compound Name8-bromononan-1-ol
PubChem CID18177005
Molecular FormulaC9H19BrO
Molecular Weight223.15 g/mol
Exact Mass222.06
IUPAC Name8-bromononan-1-ol
SMILESCC(Br)CCCCCCCO
InChIInChI=1S/C9H19BrO/c1-9(10)7-5-3-2-4-6-8-11/h9,11H,2-8H2,1H3
InChIKeyFAKIVYWHXMZKOQ-UHFFFAOYSA-N
XLogP3.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.15
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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8,8-dibromooctan-1-ol
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9-methyldecane-1,8-diol
CID 107094660
7-methyloctane-1,6-diol
CID 54253773
1,7-dibromooctane
CID 14490019
(10S)-undecane-1,10-diol
CID 129382222
henicosane-1,20-diol
CID 86247204
hexadecane-1,15-diol
CID 53400630
8,12-dimethylicosane-1,20-diol
CID 170848864
alumane;6-methylheptan-1-ol
CID 174615736

Frequently Asked Questions

What is the IUPAC name of 8-bromononan-1-ol?
The IUPAC name of 8-bromononan-1-ol (CID 18177005) is 8-bromononan-1-ol.
What is the SMILES notation for 8-bromononan-1-ol?
The canonical SMILES for 8-bromononan-1-ol is CC(Br)CCCCCCCO.
What is the InChIKey of 8-bromononan-1-ol?
The InChIKey is FAKIVYWHXMZKOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19BrO/c1-9(10)7-5-3-2-4-6-8-11/h9,11H,2-8H2,1H3.
What are the key properties of 8-bromononan-1-ol?
8-bromononan-1-ol has a molecular weight of 223.15 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromononan-1-ol is sourced from PubChem (CID 18177005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).