disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol

C15H18Na2O2 — CID 173033429

IUPACdisodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C15H16O2.2Na.2H/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;;;;/h3-10,16-17H,1-2H3;;;;/q;2*+1;2*-1
InChIKeyTWBJPYSHQFDTLX-UHFFFAOYSA-N
MW276.29 g/mol
LogP-2.34
Rot. Bonds2

About disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol

disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol (PubChem CID 173033429) has the molecular formula C15H18Na2O2 and a molecular weight of 276.29 g/mol. Its IUPAC name is disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol.

Molecular Properties

Compound Namedisodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
PubChem CID173033429
Molecular FormulaC15H18Na2O2
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Namedisodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C15H16O2.2Na.2H/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;;;;/h3-10,16-17H,1-2H3;;;;/q;2*+1;2*-1
InChIKeyTWBJPYSHQFDTLX-UHFFFAOYSA-N
XLogP-2.34
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 5-2.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The IUPAC name of disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol (CID 173033429) is disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol.
What is the SMILES notation for disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The canonical SMILES for disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol is CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The InChIKey is TWBJPYSHQFDTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2.2Na.2H/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;;;;/h3-10,16-17H,1-2H3;;;;/q;2*+1;2*-1.
What are the key properties of disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol has a molecular weight of 276.29 g/mol, XLogP of -2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol is sourced from PubChem (CID 173033429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).