[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol

C7H7F5O — CID 88890812

IUPAC[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol
SMILESOC[C@H]1C(F)C(F)=C(F)C(F)C1F
InChIInChI=1S/C7H7F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h2-5,13H,1H2/t2-,3?,4?,5?/m1/s1
InChIKeyHDEVMVJRTCWNCY-UOJHMQKMSA-N
MW202.12 g/mol
LogP1.77
Rot. Bonds1

About [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol

[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol (PubChem CID 88890812) has the molecular formula C7H7F5O and a molecular weight of 202.12 g/mol. Its IUPAC name is [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol.

Molecular Properties

Compound Name[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol
PubChem CID88890812
Molecular FormulaC7H7F5O
Molecular Weight202.12 g/mol
Exact Mass202.04
IUPAC Name[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol
SMILESOC[C@H]1C(F)C(F)=C(F)C(F)C1F
InChIInChI=1S/C7H7F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h2-5,13H,1H2/t2-,3?,4?,5?/m1/s1
InChIKeyHDEVMVJRTCWNCY-UOJHMQKMSA-N
XLogP1.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.12
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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4-amino-3-fluoro-2-(hydroxymethyl)cyclopentan-1-ol
CID 14888493
[2-fluoro-3-(2-methylphenyl)cyclopropyl]methanol
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CID 12573128
1,2,3,3,4,5,6-heptafluorocyclohexene
CID 87084406
cis-(2R,3S)-2-fluoro-3-(hydroxymethyl)cyclobutan-1-one
CID 66739674
(1S,2S,3S,5R,6S,7R)-8-(hydroxymethyl)cyclooctane-1,2,3,4,5,6,7-heptol
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CID 25167508
CID 163993340
CID 163993340
(1R,2S,3R,4S,4aR,5S,6R,7R,8S,8aR)-8-(hydroxymethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,2,3,4,5,6,7-heptol
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Frequently Asked Questions

What is the IUPAC name of [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol?
The IUPAC name of [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol (CID 88890812) is [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol.
What is the SMILES notation for [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol?
The canonical SMILES for [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol is OC[C@H]1C(F)C(F)=C(F)C(F)C1F.
What is the InChIKey of [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol?
The InChIKey is HDEVMVJRTCWNCY-UOJHMQKMSA-N. The full InChI is InChI=1S/C7H7F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h2-5,13H,1H2/t2-,3?,4?,5?/m1/s1.
What are the key properties of [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol?
[(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol has a molecular weight of 202.12 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2,3,4,5,6-pentafluorocyclohex-3-en-1-yl]methanol is sourced from PubChem (CID 88890812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).