4-methyl-5H-chromene

C10H10O — CID 150633397

IUPAC4-methyl-5H-chromene
SMILESCC1=C2CC=CC=C2OC=C1
InChIInChI=1S/C10H10O/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-3,5-7H,4H2,1H3
InChIKeyIYJIQPRFXIGJRH-UHFFFAOYSA-N
MW146.19 g/mol
LogP2.69
Rot. Bonds

About 4-methyl-5H-chromene

4-methyl-5H-chromene (PubChem CID 150633397) has the molecular formula C10H10O and a molecular weight of 146.19 g/mol. Its IUPAC name is 4-methyl-5H-chromene.

Molecular Properties

Compound Name4-methyl-5H-chromene
PubChem CID150633397
Molecular FormulaC10H10O
Molecular Weight146.19 g/mol
Exact Mass146.07
IUPAC Name4-methyl-5H-chromene
SMILESCC1=C2CC=CC=C2OC=C1
InChIInChI=1S/C10H10O/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-3,5-7H,4H2,1H3
InChIKeyIYJIQPRFXIGJRH-UHFFFAOYSA-N
XLogP2.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5H-chromene?
The IUPAC name of 4-methyl-5H-chromene (CID 150633397) is 4-methyl-5H-chromene.
What is the SMILES notation for 4-methyl-5H-chromene?
The canonical SMILES for 4-methyl-5H-chromene is CC1=C2CC=CC=C2OC=C1.
What is the InChIKey of 4-methyl-5H-chromene?
The InChIKey is IYJIQPRFXIGJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-3,5-7H,4H2,1H3.
What are the key properties of 4-methyl-5H-chromene?
4-methyl-5H-chromene has a molecular weight of 146.19 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5H-chromene is sourced from PubChem (CID 150633397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).