(E)-2,2-difluoro-4-phenylpent-3-en-1-ol

C11H12F2O — CID 132517262

IUPAC(E)-2,2-difluoro-4-phenylpent-3-en-1-ol
SMILESC/C(=C\C(F)(F)CO)c1ccccc1
InChIInChI=1S/C11H12F2O/c1-9(7-11(12,13)8-14)10-5-3-2-4-6-10/h2-7,14H,8H2,1H3/b9-7+
InChIKeyUBJWKSWATVCTQY-VQHVLOKHSA-N
MW198.21 g/mol
LogP2.72
Rot. Bonds3

About (E)-2,2-difluoro-4-phenylpent-3-en-1-ol

(E)-2,2-difluoro-4-phenylpent-3-en-1-ol (PubChem CID 132517262) has the molecular formula C11H12F2O and a molecular weight of 198.21 g/mol. Its IUPAC name is (E)-2,2-difluoro-4-phenylpent-3-en-1-ol.

Molecular Properties

Compound Name(E)-2,2-difluoro-4-phenylpent-3-en-1-ol
PubChem CID132517262
Molecular FormulaC11H12F2O
Molecular Weight198.21 g/mol
Exact Mass198.09
IUPAC Name(E)-2,2-difluoro-4-phenylpent-3-en-1-ol
SMILESC/C(=C\C(F)(F)CO)c1ccccc1
InChIInChI=1S/C11H12F2O/c1-9(7-11(12,13)8-14)10-5-3-2-4-6-10/h2-7,14H,8H2,1H3/b9-7+
InChIKeyUBJWKSWATVCTQY-VQHVLOKHSA-N
XLogP2.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.21
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1,1,1-trifluoro-4-phenylpent-3-en-2-ol
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(E)-2,2-difluoro-5-phenylpent-3-en-1-ol
CID 177415471
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(5Z)-4,6-diphenylhepta-1,5-dien-4-ol
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CID 5152757
1-iodoprop-1-en-2-ylbenzene
CID 54065087
[(E)-1-chloroprop-1-en-2-yl]benzene
CID 12504275
4-phenylpent-3-ene-1,2-diol
CID 67185961
iodomethane;(Z)-3-phenylbut-2-en-1-ol;zinc
CID 135060356
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1-[(Z)-2-phenylprop-1-enyl]aziridine
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Frequently Asked Questions

What is the IUPAC name of (E)-2,2-difluoro-4-phenylpent-3-en-1-ol?
The IUPAC name of (E)-2,2-difluoro-4-phenylpent-3-en-1-ol (CID 132517262) is (E)-2,2-difluoro-4-phenylpent-3-en-1-ol.
What is the SMILES notation for (E)-2,2-difluoro-4-phenylpent-3-en-1-ol?
The canonical SMILES for (E)-2,2-difluoro-4-phenylpent-3-en-1-ol is C/C(=C\C(F)(F)CO)c1ccccc1.
What is the InChIKey of (E)-2,2-difluoro-4-phenylpent-3-en-1-ol?
The InChIKey is UBJWKSWATVCTQY-VQHVLOKHSA-N. The full InChI is InChI=1S/C11H12F2O/c1-9(7-11(12,13)8-14)10-5-3-2-4-6-10/h2-7,14H,8H2,1H3/b9-7+.
What are the key properties of (E)-2,2-difluoro-4-phenylpent-3-en-1-ol?
(E)-2,2-difluoro-4-phenylpent-3-en-1-ol has a molecular weight of 198.21 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,2-difluoro-4-phenylpent-3-en-1-ol is sourced from PubChem (CID 132517262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).