2H-chromene

C9H8O — CID 9211

IUPAC2H-chromene
SMILESC1=Cc2ccccc2OC1
InChIInChI=1S/C9H8O/c1-2-6-9-8(4-1)5-3-7-10-9/h1-6H,7H2
InChIKeyKYNSBQPICQTCGU-UHFFFAOYSA-N
MW132.16 g/mol
LogP2.09
Rot. Bonds

About 2H-chromene

2H-chromene (PubChem CID 9211) has the molecular formula C9H8O and a molecular weight of 132.16 g/mol. Its IUPAC name is 2H-chromene.

Molecular Properties

Compound Name2H-chromene
PubChem CID9211
Molecular FormulaC9H8O
Molecular Weight132.16 g/mol
Exact Mass132.06
IUPAC Name2H-chromene
SMILESC1=Cc2ccccc2OC1
InChIInChI=1S/C9H8O/c1-2-6-9-8(4-1)5-3-7-10-9/h1-6H,7H2
InChIKeyKYNSBQPICQTCGU-UHFFFAOYSA-N
XLogP2.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2H-chromene?
The IUPAC name of 2H-chromene (CID 9211) is 2H-chromene.
What is the SMILES notation for 2H-chromene?
The canonical SMILES for 2H-chromene is C1=Cc2ccccc2OC1.
What is the InChIKey of 2H-chromene?
The InChIKey is KYNSBQPICQTCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O/c1-2-6-9-8(4-1)5-3-7-10-9/h1-6H,7H2.
What are the key properties of 2H-chromene?
2H-chromene has a molecular weight of 132.16 g/mol, XLogP of 2.09, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-chromene is sourced from PubChem (CID 9211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).