(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone

C14H12O3 — CID 19890098

IUPAC(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone
SMILESCc1cc(C(=O)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C14H12O3/c1-9-8-11(4-7-13(9)16)14(17)10-2-5-12(15)6-3-10/h2-8,15-16H,1H3
InChIKeyNSVQWBBTSXGCCC-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.64
Rot. Bonds2

About (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone

(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone (PubChem CID 19890098) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone.

Molecular Properties

Compound Name(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone
PubChem CID19890098
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Name(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone
SMILESCc1cc(C(=O)c2ccc(O)cc2)ccc1O
InChIInChI=1S/C14H12O3/c1-9-8-11(4-7-13(9)16)14(17)10-2-5-12(15)6-3-10/h2-8,15-16H,1H3
InChIKeyNSVQWBBTSXGCCC-UHFFFAOYSA-N
XLogP2.64
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

bis(4-hydroxy-3,5-dimethylphenyl)methanone;bis(4-hydroxyphenyl)methanone
CID 159747693
(4-fluoro-3-methylphenyl)-(4-hydroxyphenyl)methanone
CID 82081761
(4-hydroxyphenyl)-(4-methoxy-3-methylphenyl)methanone
CID 70142361
(4-hydroxyphenyl)-(3-methylphenyl)methanone
CID 22132621
(4-hydroxy-3-methylphenyl) 4-(4-hydroxyphenyl)benzoate
CID 66793522
4-hydroxy-N,N,3-trimethylbenzamide
CID 59263635
(3,4-dihydroxyphenyl)-(3-hydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(4-hydroxyphenyl)methanone
CID 19931686
[4-(4-chloro-3-methylbenzoyl)phenyl]-(4-chloro-3-methylphenyl)methanone
CID 5143805
3-hydroxy-4-methylbenzoic acid;4-hydroxy-3-methylbenzoic acid
CID 160831829
2-bromo-1-(4-hydroxy-3-methylphenyl)ethanone
CID 11218449
(3,4-dimethylphenyl)-(4-methylphenyl)methanone;1,2,4,5-tetramethylbenzene
CID 159278284
bis(3-tert-butyl-4-hydroxyphenyl)methanone
CID 57066598

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone?
The IUPAC name of (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone (CID 19890098) is (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone.
What is the SMILES notation for (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone?
The canonical SMILES for (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone is Cc1cc(C(=O)c2ccc(O)cc2)ccc1O.
What is the InChIKey of (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone?
The InChIKey is NSVQWBBTSXGCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3/c1-9-8-11(4-7-13(9)16)14(17)10-2-5-12(15)6-3-10/h2-8,15-16H,1H3.
What are the key properties of (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone?
(4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone has a molecular weight of 228.25 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-3-methylphenyl)-(4-hydroxyphenyl)methanone is sourced from PubChem (CID 19890098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).