1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone

C17H16O2 — CID 126685866

IUPAC1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone
SMILESC/C=C\c1ccccc1Oc1ccc(C(C)=O)cc1
InChIInChI=1S/C17H16O2/c1-3-6-15-7-4-5-8-17(15)19-16-11-9-14(10-12-16)13(2)18/h3-12H,1-2H3/b6-3-
InChIKeyRHUZMNUILYXKPS-UTCJRWHESA-N
MW252.31 g/mol
LogP4.71
Rot. Bonds4

About 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone

1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone (PubChem CID 126685866) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone
PubChem CID126685866
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone
SMILESC/C=C\c1ccccc1Oc1ccc(C(C)=O)cc1
InChIInChI=1S/C17H16O2/c1-3-6-15-7-4-5-8-17(15)19-16-11-9-14(10-12-16)13(2)18/h3-12H,1-2H3/b6-3-
InChIKeyRHUZMNUILYXKPS-UTCJRWHESA-N
XLogP4.71
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(2-propan-2-yloxyphenoxy)phenyl]ethanone
CID 155743488
3-[2-(4-methylphenoxy)phenyl]prop-2-enoic acid
CID 737486
(4-acetylphenyl) (E)-3-(2-ethoxyphenyl)prop-2-enoate
CID 8764069
3-(2-phenoxyphenyl)prop-2-enoic acid
CID 737422
(4-acetylphenyl) (E)-3-(2-propoxyphenyl)prop-2-enoate
CID 19207715
(E)-3-[2-(4-fluorophenoxy)phenyl]prop-2-enoic acid
CID 5399136
methyl (E)-3-[2-[4-(4-methoxyphenoxy)phenoxy]phenyl]prop-2-enoate
CID 73427465
[4-[2-(4-benzoylphenoxy)phenoxy]phenyl]-phenylmethanone
CID 175364335
(E)-3-(2-phenoxyphenyl)prop-2-enamide
CID 1490836
5-methyl-2-(2-prop-1-enylphenoxy)benzoic acid
CID 76996043
(4-acetylphenyl) (E)-3-(2-bromophenyl)prop-2-enoate
CID 8764071
4-(4-acetylphenoxy)benzoic acid
CID 60723234

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone?
The IUPAC name of 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone (CID 126685866) is 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone.
What is the SMILES notation for 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone?
The canonical SMILES for 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone is C/C=C\c1ccccc1Oc1ccc(C(C)=O)cc1.
What is the InChIKey of 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone?
The InChIKey is RHUZMNUILYXKPS-UTCJRWHESA-N. The full InChI is InChI=1S/C17H16O2/c1-3-6-15-7-4-5-8-17(15)19-16-11-9-14(10-12-16)13(2)18/h3-12H,1-2H3/b6-3-.
What are the key properties of 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone?
1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone has a molecular weight of 252.31 g/mol, XLogP of 4.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-[(Z)-prop-1-enyl]phenoxy]phenyl]ethanone is sourced from PubChem (CID 126685866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).