CID 175749710

C14H14NaO2 — CID 175749710

IUPAC—
SMILESOc1ccccc1CCc1ccccc1O.[Na]
InChIInChI=1S/C14H14O2.Na/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16;/h1-8,15-16H,9-10H2;
InChIKeyGHYWGPUWLXLLBD-UHFFFAOYSA-N
MW237.25 g/mol
LogP2.50
Rot. Bonds3

About CID 175749710

CID 175749710 (PubChem CID 175749710) has the molecular formula C14H14NaO2 and a molecular weight of 237.25 g/mol.

Molecular Properties

Compound NameCID 175749710
PubChem CID175749710
Molecular FormulaC14H14NaO2
Molecular Weight237.25 g/mol
Exact Mass237.09
IUPAC Name—
SMILESOc1ccccc1CCc1ccccc1O.[Na]
InChIInChI=1S/C14H14O2.Na/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16;/h1-8,15-16H,9-10H2;
InChIKeyGHYWGPUWLXLLBD-UHFFFAOYSA-N
XLogP2.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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2-[2-(2-methoxyphenyl)ethyl]phenol
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2-[2-(3-hydroxyphenyl)ethyl]phenol
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2-but-3-ynylphenol
CID 14956073
2-dodecylphenol
CID 160834917
2-(12-phenyldodecyl)phenol
CID 70505621
2-(hydroxymethyl)phenol;methane
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Frequently Asked Questions

What is the IUPAC name of CID 175749710?
The IUPAC name of CID 175749710 (CID 175749710) is not available.
What is the SMILES notation for CID 175749710?
The canonical SMILES for CID 175749710 is Oc1ccccc1CCc1ccccc1O.[Na].
What is the InChIKey of CID 175749710?
The InChIKey is GHYWGPUWLXLLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2.Na/c15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16;/h1-8,15-16H,9-10H2;.
What are the key properties of CID 175749710?
CID 175749710 has a molecular weight of 237.25 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175749710 is sourced from PubChem (CID 175749710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).