4-(furan-2-yl)-2-methylbut-3-en-2-ol

C9H12O2 — CID 71370744

IUPAC4-(furan-2-yl)-2-methylbut-3-en-2-ol
SMILESCC(C)(O)C=Cc1ccco1
InChIInChI=1S/C9H12O2/c1-9(2,10)6-5-8-4-3-7-11-8/h3-7,10H,1-2H3
InChIKeyHNSOJDZTOONFDI-UHFFFAOYSA-N
MW152.19 g/mol
LogP2.06
Rot. Bonds2

About 4-(furan-2-yl)-2-methylbut-3-en-2-ol

4-(furan-2-yl)-2-methylbut-3-en-2-ol (PubChem CID 71370744) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-methylbut-3-en-2-ol.

Molecular Properties

Compound Name4-(furan-2-yl)-2-methylbut-3-en-2-ol
PubChem CID71370744
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name4-(furan-2-yl)-2-methylbut-3-en-2-ol
SMILESCC(C)(O)C=Cc1ccco1
InChIInChI=1S/C9H12O2/c1-9(2,10)6-5-8-4-3-7-11-8/h3-7,10H,1-2H3
InChIKeyHNSOJDZTOONFDI-UHFFFAOYSA-N
XLogP2.06
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,3,3-trichloroprop-1-enyl)furan
CID 56614654
CID 59090942
CID 59090942
3-(furan-2-yl)prop-2-enoic acid
CID 159116571
(E)-2-(furan-2-yl)ethenethiol
CID 87339498
(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
CID 11480633
(2R)-4-(furan-2-yl)but-3-en-2-ol
CID 131876668
4-(furan-2-yl)but-3-ene-2-thione
CID 170923429
3-(furan-2-yl)prop-2-enoyl chloride
CID 53411285
tert-butyl (E)-4-(furan-2-yl)but-3-enoate
CID 102382884
2-[(Z)-2-chloroethenyl]furan
CID 11389398
2-[(E)-2-fluoroethenyl]furan
CID 145208016
2-[(E)-2-bromoethenyl]furan
CID 10899150

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-2-methylbut-3-en-2-ol?
The IUPAC name of 4-(furan-2-yl)-2-methylbut-3-en-2-ol (CID 71370744) is 4-(furan-2-yl)-2-methylbut-3-en-2-ol.
What is the SMILES notation for 4-(furan-2-yl)-2-methylbut-3-en-2-ol?
The canonical SMILES for 4-(furan-2-yl)-2-methylbut-3-en-2-ol is CC(C)(O)C=Cc1ccco1.
What is the InChIKey of 4-(furan-2-yl)-2-methylbut-3-en-2-ol?
The InChIKey is HNSOJDZTOONFDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2/c1-9(2,10)6-5-8-4-3-7-11-8/h3-7,10H,1-2H3.
What are the key properties of 4-(furan-2-yl)-2-methylbut-3-en-2-ol?
4-(furan-2-yl)-2-methylbut-3-en-2-ol has a molecular weight of 152.19 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-methylbut-3-en-2-ol is sourced from PubChem (CID 71370744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).