6-methoxy-7-propan-2-yloxychromen-4-one

C13H14O4 — CID 134910504

IUPAC6-methoxy-7-propan-2-yloxychromen-4-one
SMILESCOc1cc2c(=O)ccoc2cc1OC(C)C
InChIInChI=1S/C13H14O4/c1-8(2)17-13-7-11-9(6-12(13)15-3)10(14)4-5-16-11/h4-8H,1-3H3
InChIKeyPGONYWZOLQWFLX-UHFFFAOYSA-N
MW234.25 g/mol
LogP2.59
Rot. Bonds3

About 6-methoxy-7-propan-2-yloxychromen-4-one

6-methoxy-7-propan-2-yloxychromen-4-one (PubChem CID 134910504) has the molecular formula C13H14O4 and a molecular weight of 234.25 g/mol. Its IUPAC name is 6-methoxy-7-propan-2-yloxychromen-4-one.

Molecular Properties

Compound Name6-methoxy-7-propan-2-yloxychromen-4-one
PubChem CID134910504
Molecular FormulaC13H14O4
Molecular Weight234.25 g/mol
Exact Mass234.09
IUPAC Name6-methoxy-7-propan-2-yloxychromen-4-one
SMILESCOc1cc2c(=O)ccoc2cc1OC(C)C
InChIInChI=1S/C13H14O4/c1-8(2)17-13-7-11-9(6-12(13)15-3)10(14)4-5-16-11/h4-8H,1-3H3
InChIKeyPGONYWZOLQWFLX-UHFFFAOYSA-N
XLogP2.59
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-(4-hydroxy-3-methoxyphenyl)chromen-4-one
CID 70491116
(4-oxochromen-6-yl) acetate
CID 119082318
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CID 68788950
1,2-diiodo-4-methoxy-5-propan-2-yloxybenzene
CID 11189277
7-methoxy-2-methyl-6-propan-2-yloxyphthalazin-1-one
CID 175748862
6-methylchromen-4-one
CID 594810
(4-oxochromen-7-yl) acetate
CID 20979816
3-bromo-6,7-dimethoxychromen-4-one
CID 67762458
5-methoxy-4-oxo-N-(4-oxochromen-6-yl)-1H-pyridine-2-carboxamide
CID 127252932
(4-oxochromen-7-yl) 4-methoxybenzoate
CID 134096425
7-methoxychromen-4-one;nonane
CID 175037162
N-(4-oxo-6-phenoxychromen-7-yl)methanesulfonamide
CID 10616480

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-7-propan-2-yloxychromen-4-one?
The IUPAC name of 6-methoxy-7-propan-2-yloxychromen-4-one (CID 134910504) is 6-methoxy-7-propan-2-yloxychromen-4-one.
What is the SMILES notation for 6-methoxy-7-propan-2-yloxychromen-4-one?
The canonical SMILES for 6-methoxy-7-propan-2-yloxychromen-4-one is COc1cc2c(=O)ccoc2cc1OC(C)C.
What is the InChIKey of 6-methoxy-7-propan-2-yloxychromen-4-one?
The InChIKey is PGONYWZOLQWFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O4/c1-8(2)17-13-7-11-9(6-12(13)15-3)10(14)4-5-16-11/h4-8H,1-3H3.
What are the key properties of 6-methoxy-7-propan-2-yloxychromen-4-one?
6-methoxy-7-propan-2-yloxychromen-4-one has a molecular weight of 234.25 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-7-propan-2-yloxychromen-4-one is sourced from PubChem (CID 134910504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).