(2,2-diphenylbenzo[h]chromen-6-yl)methanol

C26H20O2 — CID 132567770

IUPAC(2,2-diphenylbenzo[h]chromen-6-yl)methanol
SMILESOCc1cc2c(c3ccccc13)OC(c1ccccc1)(c1ccccc1)C=C2
InChIInChI=1S/C26H20O2/c27-18-20-17-19-15-16-26(21-9-3-1-4-10-21,22-11-5-2-6-12-22)28-25(19)24-14-8-7-13-23(20)24/h1-17,27H,18H2
InChIKeyGBQCPYPNVZJHNW-UHFFFAOYSA-N
MW364.44 g/mol
LogP5.68
Rot. Bonds3

About (2,2-diphenylbenzo[h]chromen-6-yl)methanol

(2,2-diphenylbenzo[h]chromen-6-yl)methanol (PubChem CID 132567770) has the molecular formula C26H20O2 and a molecular weight of 364.44 g/mol. Its IUPAC name is (2,2-diphenylbenzo[h]chromen-6-yl)methanol.

Molecular Properties

Compound Name(2,2-diphenylbenzo[h]chromen-6-yl)methanol
PubChem CID132567770
Molecular FormulaC26H20O2
Molecular Weight364.44 g/mol
Exact Mass364.15
IUPAC Name(2,2-diphenylbenzo[h]chromen-6-yl)methanol
SMILESOCc1cc2c(c3ccccc13)OC(c1ccccc1)(c1ccccc1)C=C2
InChIInChI=1S/C26H20O2/c27-18-20-17-19-15-16-26(21-9-3-1-4-10-21,22-11-5-2-6-12-22)28-25(19)24-14-8-7-13-23(20)24/h1-17,27H,18H2
InChIKeyGBQCPYPNVZJHNW-UHFFFAOYSA-N
XLogP5.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.44
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,2-diphenylbenzo[h]chromen-6-yl)methanol?
The IUPAC name of (2,2-diphenylbenzo[h]chromen-6-yl)methanol (CID 132567770) is (2,2-diphenylbenzo[h]chromen-6-yl)methanol.
What is the SMILES notation for (2,2-diphenylbenzo[h]chromen-6-yl)methanol?
The canonical SMILES for (2,2-diphenylbenzo[h]chromen-6-yl)methanol is OCc1cc2c(c3ccccc13)OC(c1ccccc1)(c1ccccc1)C=C2.
What is the InChIKey of (2,2-diphenylbenzo[h]chromen-6-yl)methanol?
The InChIKey is GBQCPYPNVZJHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20O2/c27-18-20-17-19-15-16-26(21-9-3-1-4-10-21,22-11-5-2-6-12-22)28-25(19)24-14-8-7-13-23(20)24/h1-17,27H,18H2.
What are the key properties of (2,2-diphenylbenzo[h]chromen-6-yl)methanol?
(2,2-diphenylbenzo[h]chromen-6-yl)methanol has a molecular weight of 364.44 g/mol, XLogP of 5.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-diphenylbenzo[h]chromen-6-yl)methanol is sourced from PubChem (CID 132567770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).