8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane

C23H23O2P — CID 141443497

IUPAC8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane
SMILESc1ccc(P2CCC3(CC2)OCCO3)c(-c2cccc3ccccc23)c1
InChIInChI=1S/C23H23O2P/c1-2-8-19-18(6-1)7-5-10-20(19)21-9-3-4-11-22(21)26-16-12-23(13-17-26)24-14-15-25-23/h1-11H,12-17H2
InChIKeyJIDZKPUEHBILND-UHFFFAOYSA-N
MW362.41 g/mol
LogP5.15
Rot. Bonds2

About 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane

8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane (PubChem CID 141443497) has the molecular formula C23H23O2P and a molecular weight of 362.41 g/mol. Its IUPAC name is 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane.

Molecular Properties

Compound Name8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane
PubChem CID141443497
Molecular FormulaC23H23O2P
Molecular Weight362.41 g/mol
Exact Mass362.14
IUPAC Name8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane
SMILESc1ccc(P2CCC3(CC2)OCCO3)c(-c2cccc3ccccc23)c1
InChIInChI=1S/C23H23O2P/c1-2-8-19-18(6-1)7-5-10-20(19)21-9-3-4-11-22(21)26-16-12-23(13-17-26)24-14-15-25-23/h1-11H,12-17H2
InChIKeyJIDZKPUEHBILND-UHFFFAOYSA-N
XLogP5.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.41
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769
1-naphthalen-1-yl-4-[4-[1-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]cyclohexyl]phenyl]naphthalene
CID 123884226
2-(2-naphthalen-1-ylphenyl)phenol
CID 122204114
1-(2,5-dibromo-4-naphthalen-1-ylphenyl)naphthalene
CID 18454866
2,3-dinaphthalen-1-ylfuran
CID 166006483
9,10-bis(2-naphthalen-1-ylphenyl)anthracene
CID 22138017
9-naphthalen-1-yl-10-[4-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]naphthalen-1-yl]anthracene
CID 59861499

Frequently Asked Questions

What is the IUPAC name of 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane?
The IUPAC name of 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane (CID 141443497) is 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane.
What is the SMILES notation for 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane?
The canonical SMILES for 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane is c1ccc(P2CCC3(CC2)OCCO3)c(-c2cccc3ccccc23)c1.
What is the InChIKey of 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane?
The InChIKey is JIDZKPUEHBILND-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23O2P/c1-2-8-19-18(6-1)7-5-10-20(19)21-9-3-4-11-22(21)26-16-12-23(13-17-26)24-14-15-25-23/h1-11H,12-17H2.
What are the key properties of 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane?
8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane has a molecular weight of 362.41 g/mol, XLogP of 5.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-naphthalen-1-ylphenyl)-1,4-dioxa-8-phosphaspiro[4.5]decane is sourced from PubChem (CID 141443497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).