1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene

C22H18Cl2O — CID 69256865

IUPAC1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene
SMILESC/C=C\c1cccc(-c2c(Cl)cccc2Cl)c1OCc1ccccc1
InChIInChI=1S/C22H18Cl2O/c1-2-8-17-11-6-12-18(21-19(23)13-7-14-20(21)24)22(17)25-15-16-9-4-3-5-10-16/h2-14H,15H2,1H3/b8-2-
InChIKeyARDJKZMRDGJRFN-WAPJZHGLSA-N
MW369.29 g/mol
LogP7.27
Rot. Bonds5

About 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene

1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene (PubChem CID 69256865) has the molecular formula C22H18Cl2O and a molecular weight of 369.29 g/mol. Its IUPAC name is 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene.

Molecular Properties

Compound Name1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene
PubChem CID69256865
Molecular FormulaC22H18Cl2O
Molecular Weight369.29 g/mol
Exact Mass368.07
IUPAC Name1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene
SMILESC/C=C\c1cccc(-c2c(Cl)cccc2Cl)c1OCc1ccccc1
InChIInChI=1S/C22H18Cl2O/c1-2-8-17-11-6-12-18(21-19(23)13-7-14-20(21)24)22(17)25-15-16-9-4-3-5-10-16/h2-14H,15H2,1H3/b8-2-
InChIKeyARDJKZMRDGJRFN-WAPJZHGLSA-N
XLogP7.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.29
LogP ≤ 57.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenylmethoxy-3-prop-1-enylbenzaldehyde
CID 139673280
2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene
CID 168954401
2-phenylmethoxy-3-prop-1-enylbenzoic acid
CID 71318162
1-chloro-3-methyl-2-phenylmethoxybenzene
CID 71366901
1-chloro-2-methoxy-3-[(E)-prop-1-enyl]benzene
CID 173339850
3-chloro-N-methyl-2-phenylmethoxyaniline
CID 144838514
1-chloro-2-[(E)-prop-1-enyl]benzene;ethane
CID 144702462
(E)-N-(2-chlorophenyl)-3-(3-methoxy-2-phenylmethoxyphenyl)prop-2-enamide
CID 51057801
1-phenyl-2-[(Z)-prop-1-enyl]benzene
CID 143027726
1,5-dichloro-3-(cyclopropylidenemethyl)-2-phenylmethoxybenzene
CID 102467504
1-(2-chlorophenoxy)-2-methoxy-3-[(Z)-prop-1-enyl]benzene
CID 70519497
bromomethane;N-[2-phenylmethoxy-6-[(Z)-prop-1-enyl]phenyl]formamide
CID 164875324

Frequently Asked Questions

What is the IUPAC name of 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene?
The IUPAC name of 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene (CID 69256865) is 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene.
What is the SMILES notation for 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene?
The canonical SMILES for 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene is C/C=C\c1cccc(-c2c(Cl)cccc2Cl)c1OCc1ccccc1.
What is the InChIKey of 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene?
The InChIKey is ARDJKZMRDGJRFN-WAPJZHGLSA-N. The full InChI is InChI=1S/C22H18Cl2O/c1-2-8-17-11-6-12-18(21-19(23)13-7-14-20(21)24)22(17)25-15-16-9-4-3-5-10-16/h2-14H,15H2,1H3/b8-2-.
What are the key properties of 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene?
1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene has a molecular weight of 369.29 g/mol, XLogP of 7.27, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene is sourced from PubChem (CID 69256865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).