6-diethoxyphosphorylnaphthalen-2-ol

C14H17O4P — CID 10492986

IUPAC6-diethoxyphosphorylnaphthalen-2-ol
SMILESCCOP(=O)(OCC)c1ccc2cc(O)ccc2c1
InChIInChI=1S/C14H17O4P/c1-3-17-19(16,18-4-2)14-8-6-11-9-13(15)7-5-12(11)10-14/h5-10,15H,3-4H2,1-2H3
InChIKeyZTLZELXQPXGPJT-UHFFFAOYSA-N
MW280.26 g/mol
LogP3.44
Rot. Bonds5

About 6-diethoxyphosphorylnaphthalen-2-ol

6-diethoxyphosphorylnaphthalen-2-ol (PubChem CID 10492986) has the molecular formula C14H17O4P and a molecular weight of 280.26 g/mol. Its IUPAC name is 6-diethoxyphosphorylnaphthalen-2-ol.

Molecular Properties

Compound Name6-diethoxyphosphorylnaphthalen-2-ol
PubChem CID10492986
Molecular FormulaC14H17O4P
Molecular Weight280.26 g/mol
Exact Mass280.09
IUPAC Name6-diethoxyphosphorylnaphthalen-2-ol
SMILESCCOP(=O)(OCC)c1ccc2cc(O)ccc2c1
InChIInChI=1S/C14H17O4P/c1-3-17-19(16,18-4-2)14-8-6-11-9-13(15)7-5-12(11)10-14/h5-10,15H,3-4H2,1-2H3
InChIKeyZTLZELXQPXGPJT-UHFFFAOYSA-N
XLogP3.44
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.26
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-diethoxyphosphoryl-1,2-dimethylbenzene
CID 10966692
1-bromo-2-chloro-4-diethoxyphosphorylbenzene
CID 166609988
tris(4-diethoxyphosphorylphenyl)phosphane
CID 10675951
1-diethoxyphosphoryl-3-(difluoromethyl)benzene
CID 166609915
1-diethoxyphosphoryl-3-iodobenzene
CID 18374549
5,11,17,23,29-pentakis(diethoxyphosphoryl)hexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(30),3,5,7(35),9,11,13(34),15,17,19(33),21(32),22,24,27(31),28-pentadecaene-31,32,33,34,35-pentol
CID 102025776
ethyl N-(6-hydroxynaphthalen-2-yl)carbamate
CID 68802648
ethyl bis(4-hydroxyphenyl) phosphate
CID 137357860
1-diethoxyphosphoryl-4-phenylbenzene
CID 12670613
2-(4-diethoxyphosphorylphenyl)acetic acid
CID 87462218
(4-diethoxyphosphorylphenyl)-(4-methoxyphenyl)methanamine
CID 89463039
3-diethoxyphosphorylbenzaldehyde
CID 10800178

Frequently Asked Questions

What is the IUPAC name of 6-diethoxyphosphorylnaphthalen-2-ol?
The IUPAC name of 6-diethoxyphosphorylnaphthalen-2-ol (CID 10492986) is 6-diethoxyphosphorylnaphthalen-2-ol.
What is the SMILES notation for 6-diethoxyphosphorylnaphthalen-2-ol?
The canonical SMILES for 6-diethoxyphosphorylnaphthalen-2-ol is CCOP(=O)(OCC)c1ccc2cc(O)ccc2c1.
What is the InChIKey of 6-diethoxyphosphorylnaphthalen-2-ol?
The InChIKey is ZTLZELXQPXGPJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17O4P/c1-3-17-19(16,18-4-2)14-8-6-11-9-13(15)7-5-12(11)10-14/h5-10,15H,3-4H2,1-2H3.
What are the key properties of 6-diethoxyphosphorylnaphthalen-2-ol?
6-diethoxyphosphorylnaphthalen-2-ol has a molecular weight of 280.26 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-diethoxyphosphorylnaphthalen-2-ol is sourced from PubChem (CID 10492986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).