2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol

C18H18O2 — CID 71568241

IUPAC2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol
SMILESC=C=C(c1ccccc1COC)C(O)c1ccccc1
InChIInChI=1S/C18H18O2/c1-3-16(18(19)14-9-5-4-6-10-14)17-12-8-7-11-15(17)13-20-2/h4-12,18-19H,1,13H2,2H3
InChIKeySOAGYZFTZUCOID-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.73
Rot. Bonds5

About 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol

2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol (PubChem CID 71568241) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol.

Molecular Properties

Compound Name2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol
PubChem CID71568241
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Name2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol
SMILESC=C=C(c1ccccc1COC)C(O)c1ccccc1
InChIInChI=1S/C18H18O2/c1-3-16(18(19)14-9-5-4-6-10-14)17-12-8-7-11-15(17)13-20-2/h4-12,18-19H,1,13H2,2H3
InChIKeySOAGYZFTZUCOID-UHFFFAOYSA-N
XLogP3.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-diphenylbuta-2,3-dien-1-ol
CID 10889496
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N'-amino-2-(methoxymethyl)benzenecarboximidamide
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2-(methoxymethyl)-N-methylbenzamide
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N-(2-hydroxy-4-methylpentyl)-2-(methoxymethyl)benzamide
CID 103771486
1-phenyl-2-trimethylsilylbuta-2,3-dien-1-ol
CID 12653266
(1Z)-N-methoxy-2-(methoxymethyl)benzenecarboximidoyl chloride
CID 18713744
N-(2-hydroxy-3-methylbutyl)-2-(methoxymethyl)benzamide
CID 113258914
2-[[2-(methoxymethyl)benzoyl]-propan-2-ylamino]acetic acid
CID 60832575
N,2-bis(methoxymethyl)benzamide
CID 91153220

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol?
The IUPAC name of 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol (CID 71568241) is 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol.
What is the SMILES notation for 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol?
The canonical SMILES for 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol is C=C=C(c1ccccc1COC)C(O)c1ccccc1.
What is the InChIKey of 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol?
The InChIKey is SOAGYZFTZUCOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c1-3-16(18(19)14-9-5-4-6-10-14)17-12-8-7-11-15(17)13-20-2/h4-12,18-19H,1,13H2,2H3.
What are the key properties of 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol?
2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol has a molecular weight of 266.34 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)phenyl]-1-phenylbuta-2,3-dien-1-ol is sourced from PubChem (CID 71568241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).