bis(diphenylmethanone);dihydrochloride

C26H22Cl2O2 — CID 69107757

IUPACbis(diphenylmethanone);dihydrochloride
SMILESCl.Cl.O=C(c1ccccc1)c1ccccc1.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/2C13H10O.2ClH/c2*14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h2*1-10H;2*1H
InChIKeyFMQDVLZTPSCORU-UHFFFAOYSA-N
MW437.37 g/mol
LogP6.68
Rot. Bonds4

About bis(diphenylmethanone);dihydrochloride

bis(diphenylmethanone);dihydrochloride (PubChem CID 69107757) has the molecular formula C26H22Cl2O2 and a molecular weight of 437.37 g/mol. Its IUPAC name is bis(diphenylmethanone);dihydrochloride.

Molecular Properties

Compound Namebis(diphenylmethanone);dihydrochloride
PubChem CID69107757
Molecular FormulaC26H22Cl2O2
Molecular Weight437.37 g/mol
Exact Mass436.10
IUPAC Namebis(diphenylmethanone);dihydrochloride
SMILESCl.Cl.O=C(c1ccccc1)c1ccccc1.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/2C13H10O.2ClH/c2*14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h2*1-10H;2*1H
InChIKeyFMQDVLZTPSCORU-UHFFFAOYSA-N
XLogP6.68
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.37
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 173240243
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Frequently Asked Questions

What is the IUPAC name of bis(diphenylmethanone);dihydrochloride?
The IUPAC name of bis(diphenylmethanone);dihydrochloride (CID 69107757) is bis(diphenylmethanone);dihydrochloride.
What is the SMILES notation for bis(diphenylmethanone);dihydrochloride?
The canonical SMILES for bis(diphenylmethanone);dihydrochloride is Cl.Cl.O=C(c1ccccc1)c1ccccc1.O=C(c1ccccc1)c1ccccc1.
What is the InChIKey of bis(diphenylmethanone);dihydrochloride?
The InChIKey is FMQDVLZTPSCORU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H10O.2ClH/c2*14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h2*1-10H;2*1H.
What are the key properties of bis(diphenylmethanone);dihydrochloride?
bis(diphenylmethanone);dihydrochloride has a molecular weight of 437.37 g/mol, XLogP of 6.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(diphenylmethanone);dihydrochloride is sourced from PubChem (CID 69107757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).