1,1,1,2,3,3,4-heptafluorodecan-2-ol

C10H15F7O — CID 139615340

IUPAC1,1,1,2,3,3,4-heptafluorodecan-2-ol
SMILESCCCCCCC(F)C(F)(F)C(O)(F)C(F)(F)F
InChIInChI=1S/C10H15F7O/c1-2-3-4-5-6-7(11)8(12,13)9(14,18)10(15,16)17/h7,18H,2-6H2,1H3
InChIKeyZFFKROGJEFAOCI-UHFFFAOYSA-N
MW284.22 g/mol
LogP4.15
Rot. Bonds7

About 1,1,1,2,3,3,4-heptafluorodecan-2-ol

1,1,1,2,3,3,4-heptafluorodecan-2-ol (PubChem CID 139615340) has the molecular formula C10H15F7O and a molecular weight of 284.22 g/mol. Its IUPAC name is 1,1,1,2,3,3,4-heptafluorodecan-2-ol.

Molecular Properties

Compound Name1,1,1,2,3,3,4-heptafluorodecan-2-ol
PubChem CID139615340
Molecular FormulaC10H15F7O
Molecular Weight284.22 g/mol
Exact Mass284.10
IUPAC Name1,1,1,2,3,3,4-heptafluorodecan-2-ol
SMILESCCCCCCC(F)C(F)(F)C(O)(F)C(F)(F)F
InChIInChI=1S/C10H15F7O/c1-2-3-4-5-6-7(11)8(12,13)9(14,18)10(15,16)17/h7,18H,2-6H2,1H3
InChIKeyZFFKROGJEFAOCI-UHFFFAOYSA-N
XLogP4.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.22
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10-nonadecafluoroicosan-1-ol
CID 54151908
1,2-difluoroheptane-1,1-diol
CID 151949145
2,2,3,3,4-pentafluoro-1,1,1-trimethoxydecane
CID 151380849
2,2,3,3,4,4,5-heptafluoroundecanoic acid
CID 175755726
1,1,2,2,3,3,4-heptafluorododecane-1-sulfonic acid
CID 122480783
1,1,2-trifluorohexan-1-ol
CID 142765310
triethoxy(1,1,2,2,3-pentafluorodecyl)silane
CID 139987184
1,1,2,2,3,3,4,4,5,5,6-undecafluorododecane-1-sulfonic acid
CID 122480856
11,11,12,13,14,15,15-heptafluoro-10,16-di(nonyl)-12,13,14-tris(trifluoromethyl)pentacosane
CID 58991617
1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane
CID 175798759
1,1,2,2,3,3,4-heptafluorononane-1-sulfonic acid
CID 122480823
1,1,1-trifluoro-2-(trifluoromethyl)undecane
CID 150236240

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,3,3,4-heptafluorodecan-2-ol?
The IUPAC name of 1,1,1,2,3,3,4-heptafluorodecan-2-ol (CID 139615340) is 1,1,1,2,3,3,4-heptafluorodecan-2-ol.
What is the SMILES notation for 1,1,1,2,3,3,4-heptafluorodecan-2-ol?
The canonical SMILES for 1,1,1,2,3,3,4-heptafluorodecan-2-ol is CCCCCCC(F)C(F)(F)C(O)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,3,3,4-heptafluorodecan-2-ol?
The InChIKey is ZFFKROGJEFAOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F7O/c1-2-3-4-5-6-7(11)8(12,13)9(14,18)10(15,16)17/h7,18H,2-6H2,1H3.
What are the key properties of 1,1,1,2,3,3,4-heptafluorodecan-2-ol?
1,1,1,2,3,3,4-heptafluorodecan-2-ol has a molecular weight of 284.22 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,3,3,4-heptafluorodecan-2-ol is sourced from PubChem (CID 139615340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).