2-ethenyl-4-fluoro-1-propan-2-yloxybenzene

C11H13FO — CID 25197210

IUPAC2-ethenyl-4-fluoro-1-propan-2-yloxybenzene
SMILESC=Cc1cc(F)ccc1OC(C)C
InChIInChI=1S/C11H13FO/c1-4-9-7-10(12)5-6-11(9)13-8(2)3/h4-8H,1H2,2-3H3
InChIKeyQZFOSNVXVFEIHS-UHFFFAOYSA-N
MW180.22 g/mol
LogP3.26
Rot. Bonds3

About 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene

2-ethenyl-4-fluoro-1-propan-2-yloxybenzene (PubChem CID 25197210) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene.

Molecular Properties

Compound Name2-ethenyl-4-fluoro-1-propan-2-yloxybenzene
PubChem CID25197210
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name2-ethenyl-4-fluoro-1-propan-2-yloxybenzene
SMILESC=Cc1cc(F)ccc1OC(C)C
InChIInChI=1S/C11H13FO/c1-4-9-7-10(12)5-6-11(9)13-8(2)3/h4-8H,1H2,2-3H3
InChIKeyQZFOSNVXVFEIHS-UHFFFAOYSA-N
XLogP3.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-2-methyl-1-propan-2-yloxybenzene
CID 58970665
4-fluoro-1-methoxy-2-propan-2-yloxybenzene
CID 126993061
1-ethenyl-2-fluoro-4-propan-2-yloxybenzene
CID 175665867
2-ethenyl-4-[[2-[(3-ethenyl-4-propan-2-yloxyphenoxy)methyl]phenyl]methoxy]-1-propan-2-yloxybenzene
CID 101431014
2-(3-ethenyl-4-propan-2-yloxyphenyl)-N,2-dimethylpropan-1-amine
CID 134565167
1-chloro-4-ethenyl-5-fluoro-2-propan-2-yloxybenzene
CID 70136526
2-ethenyl-3-propan-2-yloxynaphthalene;2-propan-2-yloxynaphthalene
CID 173224247
(3-ethenyl-4-propan-2-yloxyphenyl)methyl-dimethyl-[2-(trimethylazaniumyl)ethyl]azanium
CID 102326558
2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene
CID 102247848
4-ethenyl-3-propan-2-yloxybenzoyl chloride
CID 87786488
4-fluoro-2-(methoxymethoxy)-1-propan-2-yloxybenzene
CID 165354855
(1S)-1-(4-fluoro-2-propan-2-yloxyphenyl)ethanamine
CID 78935870

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene?
The IUPAC name of 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene (CID 25197210) is 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene.
What is the SMILES notation for 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene?
The canonical SMILES for 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene is C=Cc1cc(F)ccc1OC(C)C.
What is the InChIKey of 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene?
The InChIKey is QZFOSNVXVFEIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-4-9-7-10(12)5-6-11(9)13-8(2)3/h4-8H,1H2,2-3H3.
What are the key properties of 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene?
2-ethenyl-4-fluoro-1-propan-2-yloxybenzene has a molecular weight of 180.22 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-fluoro-1-propan-2-yloxybenzene is sourced from PubChem (CID 25197210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).