[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane

C10H13F2OP — CID 163242160

IUPAC[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane
SMILESCCCc1cc(OC(F)P)ccc1F
InChIInChI=1S/C10H13F2OP/c1-2-3-7-6-8(13-10(12)14)4-5-9(7)11/h4-6,10H,2-3,14H2,1H3
InChIKeyQRQOYEIGLLVVPN-UHFFFAOYSA-N
MW218.18 g/mol
LogP3.29
Rot. Bonds4

About [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane

[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane (PubChem CID 163242160) has the molecular formula C10H13F2OP and a molecular weight of 218.18 g/mol. Its IUPAC name is [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane.

Molecular Properties

Compound Name[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane
PubChem CID163242160
Molecular FormulaC10H13F2OP
Molecular Weight218.18 g/mol
Exact Mass218.07
IUPAC Name[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane
SMILESCCCc1cc(OC(F)P)ccc1F
InChIInChI=1S/C10H13F2OP/c1-2-3-7-6-8(13-10(12)14)4-5-9(7)11/h4-6,10H,2-3,14H2,1H3
InChIKeyQRQOYEIGLLVVPN-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.18
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

4-(cyclopropylmethoxy)-1-fluoro-2-propylbenzene;propane
CID 142580919
4-fluoro-3-propylbenzoic acid
CID 11745258
8-(2-fluoro-5-propoxyphenyl)-2-methyloctan-3-one
CID 157048856
N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide
CID 86035442
3-(2-fluoro-5-methoxyphenyl)propanoic acid
CID 83402634
N-(4-fluoro-3-propylphenyl)-5-methoxypyridine-2-carboxamide
CID 126634300
2-(3,4-difluorophenoxy)-N-ethylpropan-1-amine
CID 62485370
2-ethyl-1-fluoro-4-(fluoromethoxy)benzene
CID 118671621
4-[5-[2-(ethylamino)ethoxy]-2-fluorophenyl]butan-2-one
CID 142409708
4-[(1R)-2,2-dimethylcyclopropyl]-1-fluoro-2-propylbenzene
CID 142058001
5-(4-fluoro-3-propylphenyl)-4-methylpent-1-yn-3-one
CID 154931374
2-[2-fluoro-5-(trifluoromethoxy)phenyl]ethanamine
CID 83410120

Frequently Asked Questions

What is the IUPAC name of [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane?
The IUPAC name of [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane (CID 163242160) is [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane.
What is the SMILES notation for [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane?
The canonical SMILES for [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane is CCCc1cc(OC(F)P)ccc1F.
What is the InChIKey of [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane?
The InChIKey is QRQOYEIGLLVVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2OP/c1-2-3-7-6-8(13-10(12)14)4-5-9(7)11/h4-6,10H,2-3,14H2,1H3.
What are the key properties of [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane?
[fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane has a molecular weight of 218.18 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [fluoro-(4-fluoro-3-propylphenoxy)methyl]phosphane is sourced from PubChem (CID 163242160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).