(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol

C17H18OSe2 — CID 11153665

IUPAC(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol
SMILESCCC(O)/C(=C/[Se]c1ccccc1)[Se]c1ccccc1
InChIInChI=1S/C17H18OSe2/c1-2-16(18)17(20-15-11-7-4-8-12-15)13-19-14-9-5-3-6-10-14/h3-13,16,18H,2H2,1H3/b17-13-
InChIKeyFFVBBOVYQNRGFT-LGMDPLHJSA-N
MW396.25 g/mol
LogP1.66
Rot. Bonds6

About (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol

(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol (PubChem CID 11153665) has the molecular formula C17H18OSe2 and a molecular weight of 396.25 g/mol. Its IUPAC name is (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol.

Molecular Properties

Compound Name(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol
PubChem CID11153665
Molecular FormulaC17H18OSe2
Molecular Weight396.25 g/mol
Exact Mass397.97
IUPAC Name(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol
SMILESCCC(O)/C(=C/[Se]c1ccccc1)[Se]c1ccccc1
InChIInChI=1S/C17H18OSe2/c1-2-16(18)17(20-15-11-7-4-8-12-15)13-19-14-9-5-3-6-10-14/h3-13,16,18H,2H2,1H3/b17-13-
InChIKeyFFVBBOVYQNRGFT-LGMDPLHJSA-N
XLogP1.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.25
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Phenylselanylpropan-2-ol
CID 11183499
2-Propanol, 1-(diphenylphosphino)-
CID 2828340
2-(Phenylselanyl)cyclohexan-1-ol
CID 12531121
(Z)-3-triphenylstannylprop-2-en-1-ol
CID 54600851
(2S)-1-diphenylphosphanylpropan-2-ol
CID 796909
4-[Tert-butyl(diphenyl)silyl]butan-2-ol
CID 9995683
(Z)-2,3-bis(phenylselanyl)prop-2-en-1-ol
CID 11187760
(Z)-2-methyl-3,4-bis(phenylselanyl)but-3-en-2-ol
CID 12170665
4-Triphenylplumbylbutan-2-ol
CID 13358617
2-(Phenylselanyl)prop-2-en-1-ol
CID 13514485
4-Phenylselanylbutan-2-ol
CID 14069480
3-Diphenylphosphoryl-5-methylhepta-3,4-dien-2-ol
CID 102358452

Frequently Asked Questions

What is the IUPAC name of (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol?
The IUPAC name of (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol (CID 11153665) is (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol.
What is the SMILES notation for (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol?
The canonical SMILES for (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol is CCC(O)/C(=C/[Se]c1ccccc1)[Se]c1ccccc1.
What is the InChIKey of (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol?
The InChIKey is FFVBBOVYQNRGFT-LGMDPLHJSA-N. The full InChI is InChI=1S/C17H18OSe2/c1-2-16(18)17(20-15-11-7-4-8-12-15)13-19-14-9-5-3-6-10-14/h3-13,16,18H,2H2,1H3/b17-13-.
What are the key properties of (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol?
(Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol has a molecular weight of 396.25 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,2-bis(phenylselanyl)pent-1-en-3-ol is sourced from PubChem (CID 11153665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).