7-methyl-2-phenylchromenylium-6-ol

C16H13O2+ — CID 134912245

IUPAC7-methyl-2-phenylchromenylium-6-ol
SMILESCc1cc2[o+]c(-c3ccccc3)ccc2cc1O
InChIInChI=1S/C16H12O2/c1-11-9-16-13(10-14(11)17)7-8-15(18-16)12-5-3-2-4-6-12/h2-10H,1H3/p+1
InChIKeyKPXZPZONXIAOCG-UHFFFAOYSA-O
MW237.28 g/mol
LogP4.39
Rot. Bonds1

About 7-methyl-2-phenylchromenylium-6-ol

7-methyl-2-phenylchromenylium-6-ol (PubChem CID 134912245) has the molecular formula C16H13O2+ and a molecular weight of 237.28 g/mol. Its IUPAC name is 7-methyl-2-phenylchromenylium-6-ol.

Molecular Properties

Compound Name7-methyl-2-phenylchromenylium-6-ol
PubChem CID134912245
Molecular FormulaC16H13O2+
Molecular Weight237.28 g/mol
Exact Mass237.09
IUPAC Name7-methyl-2-phenylchromenylium-6-ol
SMILESCc1cc2[o+]c(-c3ccccc3)ccc2cc1O
InChIInChI=1S/C16H12O2/c1-11-9-16-13(10-14(11)17)7-8-15(18-16)12-5-3-2-4-6-12/h2-10H,1H3/p+1
InChIKeyKPXZPZONXIAOCG-UHFFFAOYSA-O
XLogP4.39
TPSA31.53 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Related Compounds

2-phenylchromenylium
CID 159562545
2-(4-methylphenyl)chromenylium
CID 3826710
2-methyl-4-(4-phenylphenyl)phenol
CID 83131251
2-methyl-4-phenyl-5-propan-2-ylphenol
CID 174789166
2-(4-hydroxyphenyl)chromenylium-7-ol chloride
CID 12735693
6-(2-methylphenyl)naphthalen-1-ol
CID 71167346
4-(4-hydroxy-3-phenylphenyl)-2-methylphenol
CID 139534984
2,5-dimethyl-4-(3-methylphenyl)phenol
CID 101298799
3-methyl-2,6-diphenylpyrylium perchlorate
CID 14568808
7-chloro-3-methylnaphthalen-2-ol
CID 20595192
1-methyl-3-phenylbenzo[f]chromen-4-ium tetrafluoroborate
CID 153489891
4-methyl-2-phenylbenzo[h]chromen-1-ium
CID 142492639

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-phenylchromenylium-6-ol?
The IUPAC name of 7-methyl-2-phenylchromenylium-6-ol (CID 134912245) is 7-methyl-2-phenylchromenylium-6-ol.
What is the SMILES notation for 7-methyl-2-phenylchromenylium-6-ol?
The canonical SMILES for 7-methyl-2-phenylchromenylium-6-ol is Cc1cc2[o+]c(-c3ccccc3)ccc2cc1O.
What is the InChIKey of 7-methyl-2-phenylchromenylium-6-ol?
The InChIKey is KPXZPZONXIAOCG-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H12O2/c1-11-9-16-13(10-14(11)17)7-8-15(18-16)12-5-3-2-4-6-12/h2-10H,1H3/p+1.
What are the key properties of 7-methyl-2-phenylchromenylium-6-ol?
7-methyl-2-phenylchromenylium-6-ol has a molecular weight of 237.28 g/mol, XLogP of 4.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-phenylchromenylium-6-ol is sourced from PubChem (CID 134912245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).