1,2-dihydrocyclopenta[b]chromene

C12H10O — CID 86188664

IUPAC1,2-dihydrocyclopenta[b]chromene
SMILESC1=C2CCC=C2Oc2ccccc21
InChIInChI=1S/C12H10O/c1-2-6-11-9(4-1)8-10-5-3-7-12(10)13-11/h1-2,4,6-8H,3,5H2
InChIKeyHBLJCWJDBFTLJU-UHFFFAOYSA-N
MW170.21 g/mol
LogP3.14
Rot. Bonds

About 1,2-dihydrocyclopenta[b]chromene

1,2-dihydrocyclopenta[b]chromene (PubChem CID 86188664) has the molecular formula C12H10O and a molecular weight of 170.21 g/mol. Its IUPAC name is 1,2-dihydrocyclopenta[b]chromene.

Molecular Properties

Compound Name1,2-dihydrocyclopenta[b]chromene
PubChem CID86188664
Molecular FormulaC12H10O
Molecular Weight170.21 g/mol
Exact Mass170.07
IUPAC Name1,2-dihydrocyclopenta[b]chromene
SMILESC1=C2CCC=C2Oc2ccccc21
InChIInChI=1S/C12H10O/c1-2-6-11-9(4-1)8-10-5-3-7-12(10)13-11/h1-2,4,6-8H,3,5H2
InChIKeyHBLJCWJDBFTLJU-UHFFFAOYSA-N
XLogP3.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-methoxy-1,2-dihydrocyclopenta[b]chromene
CID 86188658
11-oxatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,8,12,16-heptaene
CID 86188661
3-[4-(2H-chromen-3-yl)phenyl]-2H-chromene
CID 101244851
2-methyl-3H-xanthene
CID 91540179
1,1'-spirobi[xanthene]
CID 142709696
chromeno[3,2-c]diazepine
CID 155923318
(1Z,25Z)-9,18-dioxatetracyclo[24.3.1.03,8.019,24]triaconta-1,3,5,7,19,21,23,25-octaen-30-one
CID 177476472
2-amino-4H-chromeno[2,3-b]pyridine-3-carbonitrile
CID 156630810
2-(2H-chromen-3-yl)pyridine
CID 10859833
2-(trifluoromethyl)thiopyrano[3,2-b]chromene;dihydrochloride
CID 159983148
isochromeno[4,3-b]chromene
CID 91373309
1-benzo[b][1]benzoxepin-5-yl-N-methylmethanamine
CID 10037165

Frequently Asked Questions

What is the IUPAC name of 1,2-dihydrocyclopenta[b]chromene?
The IUPAC name of 1,2-dihydrocyclopenta[b]chromene (CID 86188664) is 1,2-dihydrocyclopenta[b]chromene.
What is the SMILES notation for 1,2-dihydrocyclopenta[b]chromene?
The canonical SMILES for 1,2-dihydrocyclopenta[b]chromene is C1=C2CCC=C2Oc2ccccc21.
What is the InChIKey of 1,2-dihydrocyclopenta[b]chromene?
The InChIKey is HBLJCWJDBFTLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O/c1-2-6-11-9(4-1)8-10-5-3-7-12(10)13-11/h1-2,4,6-8H,3,5H2.
What are the key properties of 1,2-dihydrocyclopenta[b]chromene?
1,2-dihydrocyclopenta[b]chromene has a molecular weight of 170.21 g/mol, XLogP of 3.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydrocyclopenta[b]chromene is sourced from PubChem (CID 86188664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).