CID 172763014

C8H10LiO — CID 172763014

IUPAC—
SMILESCc1ccc(O)c(C)c1.[Li]
InChIInChI=1S/C8H10O.Li/c1-6-3-4-8(9)7(2)5-6;/h3-5,9H,1-2H3;
InChIKeyLYEDGKPMDYUPDP-UHFFFAOYSA-N
MW129.11 g/mol
LogP1.63
Rot. Bonds

About CID 172763014

CID 172763014 (PubChem CID 172763014) has the molecular formula C8H10LiO and a molecular weight of 129.11 g/mol.

Molecular Properties

Compound NameCID 172763014
PubChem CID172763014
Molecular FormulaC8H10LiO
Molecular Weight129.11 g/mol
Exact Mass129.09
IUPAC Name—
SMILESCc1ccc(O)c(C)c1.[Li]
InChIInChI=1S/C8H10O.Li/c1-6-3-4-8(9)7(2)5-6;/h3-5,9H,1-2H3;
InChIKeyLYEDGKPMDYUPDP-UHFFFAOYSA-N
XLogP1.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.11
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 172763014?
The IUPAC name of CID 172763014 (CID 172763014) is not available.
What is the SMILES notation for CID 172763014?
The canonical SMILES for CID 172763014 is Cc1ccc(O)c(C)c1.[Li].
What is the InChIKey of CID 172763014?
The InChIKey is LYEDGKPMDYUPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O.Li/c1-6-3-4-8(9)7(2)5-6;/h3-5,9H,1-2H3;.
What are the key properties of CID 172763014?
CID 172763014 has a molecular weight of 129.11 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172763014 is sourced from PubChem (CID 172763014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).