1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene

C16H15ClO2 — CID 70519497

IUPAC1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1cccc(Oc2ccccc2Cl)c1OC
InChIInChI=1S/C16H15ClO2/c1-3-7-12-8-6-11-15(16(12)18-2)19-14-10-5-4-9-13(14)17/h3-11H,1-2H3/b7-3-
InChIKeyDYIRMDFQJAGAGP-CLTKARDFSA-N
MW274.75 g/mol
LogP5.17
Rot. Bonds4

About 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene

1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene (PubChem CID 70519497) has the molecular formula C16H15ClO2 and a molecular weight of 274.75 g/mol. Its IUPAC name is 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene.

Molecular Properties

Compound Name1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene
PubChem CID70519497
Molecular FormulaC16H15ClO2
Molecular Weight274.75 g/mol
Exact Mass274.08
IUPAC Name1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1cccc(Oc2ccccc2Cl)c1OC
InChIInChI=1S/C16H15ClO2/c1-3-7-12-8-6-11-15(16(12)18-2)19-14-10-5-4-9-13(14)17/h3-11H,1-2H3/b7-3-
InChIKeyDYIRMDFQJAGAGP-CLTKARDFSA-N
XLogP5.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.75
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-2-methoxy-3-[(E)-prop-1-enyl]benzene
CID 173339850
1-chloro-2-[(E)-prop-1-enyl]benzene;ethane
CID 144702462
2-methoxy-3-(2-methylphenoxy)benzaldehyde
CID 13066662
2-[(2-methoxy-3-prop-1-enylphenoxy)methyl]oxirane
CID 56607199
1-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dimethoxybenzene
CID 138660638
1,5-bis(prop-1-enyl)naphthalene
CID 139669430
1-chloro-2-methoxybenzene
CID 13011
1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
CID 173291827
1,2,3-trimethoxy-4-[(Z)-prop-1-enyl]benzene
CID 20839497
1-(3,4-dichlorophenyl)-3-(2,3-dimethoxyphenyl)prop-2-en-1-one
CID 5063512
(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol
CID 67913122
1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene
CID 69256865

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene?
The IUPAC name of 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene (CID 70519497) is 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene.
What is the SMILES notation for 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene?
The canonical SMILES for 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene is C/C=C\c1cccc(Oc2ccccc2Cl)c1OC.
What is the InChIKey of 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene?
The InChIKey is DYIRMDFQJAGAGP-CLTKARDFSA-N. The full InChI is InChI=1S/C16H15ClO2/c1-3-7-12-8-6-11-15(16(12)18-2)19-14-10-5-4-9-13(14)17/h3-11H,1-2H3/b7-3-.
What are the key properties of 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene?
1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene has a molecular weight of 274.75 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene is sourced from PubChem (CID 70519497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).