(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol

C20H24O3 — CID 11324417

IUPAC(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol
SMILESCCCC(O)/C=C/c1ccc(OCc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24O3/c1-3-4-18(21)10-5-16-6-13-20(14-7-16)23-15-17-8-11-19(22-2)12-9-17/h5-14,18,21H,3-4,15H2,1-2H3/b10-5+
InChIKeyXCDDRHAKDMCSLM-BJMVGYQFSA-N
MW312.41 g/mol
LogP4.45
Rot. Bonds8

About (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol

(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol (PubChem CID 11324417) has the molecular formula C20H24O3 and a molecular weight of 312.41 g/mol. Its IUPAC name is (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol.

Molecular Properties

Compound Name(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol
PubChem CID11324417
Molecular FormulaC20H24O3
Molecular Weight312.41 g/mol
Exact Mass312.17
IUPAC Name(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol
SMILESCCCC(O)/C=C/c1ccc(OCc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24O3/c1-3-4-18(21)10-5-16-6-13-20(14-7-16)23-15-17-8-11-19(22-2)12-9-17/h5-14,18,21H,3-4,15H2,1-2H3/b10-5+
InChIKeyXCDDRHAKDMCSLM-BJMVGYQFSA-N
XLogP4.45
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(E)-1-[(4-methoxyphenyl)methoxy]hex-1-en-3-ol
CID 118194730
5-[4-[(4-methoxyphenyl)methoxy]phenyl]pent-4-en-2-amine
CID 70594419
(E,2S)-1-chloro-4-(4-methoxyphenyl)but-3-en-2-ol
CID 102199471
(Z)-1-[(4-methoxyphenyl)methoxy]oct-1-en-3-ol
CID 10587712
(E)-1-(diethylamino)-4-(4-methoxyphenyl)but-3-en-2-ol
CID 6366807
(E)-3-(4-methoxyphenyl)prop-2-ene-1,1-diol
CID 88979121
1-phenylmethoxy-4-(4-phenylmethoxyphenyl)but-3-en-2-ol
CID 70426552
1-(4-methoxyphenyl)hexa-1,5-dien-3-ol
CID 53401972
1-[4-[(4-methoxyphenyl)methoxy]phenyl]butan-1-one
CID 134129695
2,3-bis[[4-[(4-methoxyphenyl)methoxy]phenyl]methylidene]butanedial
CID 72968223
3-[4-[(4-methoxyphenyl)methoxy]phenyl]prop-2-enoic acid;propyl prop-2-enoate
CID 157202203
1-methoxy-4-[[4-(2-propylnonyl)phenoxy]methyl]benzene
CID 142632649

Frequently Asked Questions

What is the IUPAC name of (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol?
The IUPAC name of (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol (CID 11324417) is (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol.
What is the SMILES notation for (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol?
The canonical SMILES for (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol is CCCC(O)/C=C/c1ccc(OCc2ccc(OC)cc2)cc1.
What is the InChIKey of (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol?
The InChIKey is XCDDRHAKDMCSLM-BJMVGYQFSA-N. The full InChI is InChI=1S/C20H24O3/c1-3-4-18(21)10-5-16-6-13-20(14-7-16)23-15-17-8-11-19(22-2)12-9-17/h5-14,18,21H,3-4,15H2,1-2H3/b10-5+.
What are the key properties of (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol?
(E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol has a molecular weight of 312.41 g/mol, XLogP of 4.45, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]hex-1-en-3-ol is sourced from PubChem (CID 11324417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).