CID 144806033

C8H9F2O — CID 144806033

IUPAC—
SMILESCc1cc(F)c(C)c(F)c1.[OH]
InChIInChI=1S/C8H8F2.HO/c1-5-3-7(9)6(2)8(10)4-5;/h3-4H,1-2H3;1H
InChIKeyNDTIVUWCAQDNLH-UHFFFAOYSA-N
MW159.16 g/mol
LogP2.40
Rot. Bonds

About CID 144806033

CID 144806033 (PubChem CID 144806033) has the molecular formula C8H9F2O and a molecular weight of 159.16 g/mol.

Molecular Properties

Compound NameCID 144806033
PubChem CID144806033
Molecular FormulaC8H9F2O
Molecular Weight159.16 g/mol
Exact Mass159.06
IUPAC Name—
SMILESCc1cc(F)c(C)c(F)c1.[OH]
InChIInChI=1S/C8H8F2.HO/c1-5-3-7(9)6(2)8(10)4-5;/h3-4H,1-2H3;1H
InChIKeyNDTIVUWCAQDNLH-UHFFFAOYSA-N
XLogP2.40
TPSA30.00 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.16
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 144806033?
The IUPAC name of CID 144806033 (CID 144806033) is not available.
What is the SMILES notation for CID 144806033?
The canonical SMILES for CID 144806033 is Cc1cc(F)c(C)c(F)c1.[OH].
What is the InChIKey of CID 144806033?
The InChIKey is NDTIVUWCAQDNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2.HO/c1-5-3-7(9)6(2)8(10)4-5;/h3-4H,1-2H3;1H.
What are the key properties of CID 144806033?
CID 144806033 has a molecular weight of 159.16 g/mol, XLogP of 2.40, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 144806033 is sourced from PubChem (CID 144806033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).