7-(4-methylphenyl)-3,4-dihydro-2H-chromene

C16H16O — CID 144987040

IUPAC7-(4-methylphenyl)-3,4-dihydro-2H-chromene
SMILESCc1ccc(-c2ccc3c(c2)OCCC3)cc1
InChIInChI=1S/C16H16O/c1-12-4-6-13(7-5-12)15-9-8-14-3-2-10-17-16(14)11-15/h4-9,11H,2-3,10H2,1H3
InChIKeyWVULXOGTKUCZRZ-UHFFFAOYSA-N
MW224.30 g/mol
LogP3.99
Rot. Bonds1

About 7-(4-methylphenyl)-3,4-dihydro-2H-chromene

7-(4-methylphenyl)-3,4-dihydro-2H-chromene (PubChem CID 144987040) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 7-(4-methylphenyl)-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name7-(4-methylphenyl)-3,4-dihydro-2H-chromene
PubChem CID144987040
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name7-(4-methylphenyl)-3,4-dihydro-2H-chromene
SMILESCc1ccc(-c2ccc3c(c2)OCCC3)cc1
InChIInChI=1S/C16H16O/c1-12-4-6-13(7-5-12)15-9-8-14-3-2-10-17-16(14)11-15/h4-9,11H,2-3,10H2,1H3
InChIKeyWVULXOGTKUCZRZ-UHFFFAOYSA-N
XLogP3.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[4-[4-(3,4-dihydro-2H-chromen-6-yl)phenyl]phenyl]-3,4-dihydro-2H-chromene
CID 71339532
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
N-methyl-N-(3-methylphenyl)-3,4-dihydro-2H-chromen-7-amine
CID 144986840
ethane;7-methyl-2,3,4,5-tetrahydro-1-benzoxepine
CID 143911353
2-(2,3-dihydro-1-benzofuran-6-yl)-4-methylbenzonitrile
CID 96595651
6-(4-pentan-3-ylphenyl)-3,4-dihydro-2H-chromene
CID 126760659
3,4-dihydro-2H-chromene;ethane
CID 91076984
acetic acid;6-methyl-2,3-dihydro-1-benzofuran
CID 156753873
3,4-dihydro-2H-chromene;4-methylbenzenesulfonic acid
CID 86612270
1-[4-(3,4-dihydro-2H-chromen-6-yl)phenyl]-N-methylethanamine
CID 61032925
3,4,6,7,8,9-hexahydro-2H-pyrano[3,2-h][1]benzoxepine
CID 609172
[7-(4-methylphenyl)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 118597841

Frequently Asked Questions

What is the IUPAC name of 7-(4-methylphenyl)-3,4-dihydro-2H-chromene?
The IUPAC name of 7-(4-methylphenyl)-3,4-dihydro-2H-chromene (CID 144987040) is 7-(4-methylphenyl)-3,4-dihydro-2H-chromene.
What is the SMILES notation for 7-(4-methylphenyl)-3,4-dihydro-2H-chromene?
The canonical SMILES for 7-(4-methylphenyl)-3,4-dihydro-2H-chromene is Cc1ccc(-c2ccc3c(c2)OCCC3)cc1.
What is the InChIKey of 7-(4-methylphenyl)-3,4-dihydro-2H-chromene?
The InChIKey is WVULXOGTKUCZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-12-4-6-13(7-5-12)15-9-8-14-3-2-10-17-16(14)11-15/h4-9,11H,2-3,10H2,1H3.
What are the key properties of 7-(4-methylphenyl)-3,4-dihydro-2H-chromene?
7-(4-methylphenyl)-3,4-dihydro-2H-chromene has a molecular weight of 224.30 g/mol, XLogP of 3.99, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methylphenyl)-3,4-dihydro-2H-chromene is sourced from PubChem (CID 144987040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).