(E)-1-phenoxyprop-1-en-1-ol

C9H10O2 — CID 21243991

IUPAC(E)-1-phenoxyprop-1-en-1-ol
SMILESC/C=C(\O)Oc1ccccc1
InChIInChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2-7,10H,1H3/b9-2+
InChIKeySWQVMNMCLOEIHC-XNWCZRBMSA-N
MW150.18 g/mol
LogP2.48
Rot. Bonds2

About (E)-1-phenoxyprop-1-en-1-ol

(E)-1-phenoxyprop-1-en-1-ol (PubChem CID 21243991) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is (E)-1-phenoxyprop-1-en-1-ol.

Molecular Properties

Compound Name(E)-1-phenoxyprop-1-en-1-ol
PubChem CID21243991
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Name(E)-1-phenoxyprop-1-en-1-ol
SMILESC/C=C(\O)Oc1ccccc1
InChIInChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2-7,10H,1H3/b9-2+
InChIKeySWQVMNMCLOEIHC-XNWCZRBMSA-N
XLogP2.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze (E)-1-phenoxyprop-1-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methoxyethenoxybenzene
CID 57063667
phenyl carbamate;prop-1-ene
CID 158313196
phenyl N-ethylidenecarbamate
CID 57026062
1-chloroprop-1-en-2-yloxybenzene
CID 525301
diphenyl oxalate;ethane
CID 162013592
triethyl(1-phenoxyprop-1-enyl)silane
CID 23265307
[(E)-but-2-en-2-yl] phenyl carbonate
CID 121217638
phenyl acetate;hydroiodide
CID 172788123
phenoxycarbonyl 2-methylbut-2-enoate
CID 175490227
(E,2Z)-2-ethylidene-5-oxo-5-phenoxypent-3-enoic acid
CID 174429213
1-[(2E,4Z)-hexa-2,4-dien-3-yl]oxy-4-phenoxybenzene
CID 167082780
sodium;hydride;phenyl acetate
CID 159991718

Frequently Asked Questions

What is the IUPAC name of (E)-1-phenoxyprop-1-en-1-ol?
The IUPAC name of (E)-1-phenoxyprop-1-en-1-ol (CID 21243991) is (E)-1-phenoxyprop-1-en-1-ol.
What is the SMILES notation for (E)-1-phenoxyprop-1-en-1-ol?
The canonical SMILES for (E)-1-phenoxyprop-1-en-1-ol is C/C=C(\O)Oc1ccccc1.
What is the InChIKey of (E)-1-phenoxyprop-1-en-1-ol?
The InChIKey is SWQVMNMCLOEIHC-XNWCZRBMSA-N. The full InChI is InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2-7,10H,1H3/b9-2+.
What are the key properties of (E)-1-phenoxyprop-1-en-1-ol?
(E)-1-phenoxyprop-1-en-1-ol has a molecular weight of 150.18 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenoxyprop-1-en-1-ol is sourced from PubChem (CID 21243991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).