(6R)-6-amino-9,9-difluorodecan-1-ol

C10H21F2NO — CID 163278412

IUPAC(6R)-6-amino-9,9-difluorodecan-1-ol
SMILESCC(F)(F)CC[C@H](N)CCCCCO
InChIInChI=1S/C10H21F2NO/c1-10(11,12)7-6-9(13)5-3-2-4-8-14/h9,14H,2-8,13H2,1H3/t9-/m1/s1
InChIKeyIUBRSQIMXDNOAB-SECBINFHSA-N
MW209.28 g/mol
LogP2.30
Rot. Bonds8

About (6R)-6-amino-9,9-difluorodecan-1-ol

(6R)-6-amino-9,9-difluorodecan-1-ol (PubChem CID 163278412) has the molecular formula C10H21F2NO and a molecular weight of 209.28 g/mol. Its IUPAC name is (6R)-6-amino-9,9-difluorodecan-1-ol.

Molecular Properties

Compound Name(6R)-6-amino-9,9-difluorodecan-1-ol
PubChem CID163278412
Molecular FormulaC10H21F2NO
Molecular Weight209.28 g/mol
Exact Mass209.16
IUPAC Name(6R)-6-amino-9,9-difluorodecan-1-ol
SMILESCC(F)(F)CC[C@H](N)CCCCCO
InChIInChI=1S/C10H21F2NO/c1-10(11,12)7-6-9(13)5-3-2-4-8-14/h9,14H,2-8,13H2,1H3/t9-/m1/s1
InChIKeyIUBRSQIMXDNOAB-SECBINFHSA-N
XLogP2.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.28
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-amino-9,9-difluorodecan-1-ol?
The IUPAC name of (6R)-6-amino-9,9-difluorodecan-1-ol (CID 163278412) is (6R)-6-amino-9,9-difluorodecan-1-ol.
What is the SMILES notation for (6R)-6-amino-9,9-difluorodecan-1-ol?
The canonical SMILES for (6R)-6-amino-9,9-difluorodecan-1-ol is CC(F)(F)CC[C@H](N)CCCCCO.
What is the InChIKey of (6R)-6-amino-9,9-difluorodecan-1-ol?
The InChIKey is IUBRSQIMXDNOAB-SECBINFHSA-N. The full InChI is InChI=1S/C10H21F2NO/c1-10(11,12)7-6-9(13)5-3-2-4-8-14/h9,14H,2-8,13H2,1H3/t9-/m1/s1.
What are the key properties of (6R)-6-amino-9,9-difluorodecan-1-ol?
(6R)-6-amino-9,9-difluorodecan-1-ol has a molecular weight of 209.28 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-amino-9,9-difluorodecan-1-ol is sourced from PubChem (CID 163278412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).