10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine

C19H17OP — CID 102041839

IUPAC10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine
SMILESCc1ccc2c(c1)P(C1C=CC=C1)c1cc(C)ccc1O2
InChIInChI=1S/C19H17OP/c1-13-7-9-16-18(11-13)21(15-5-3-4-6-15)19-12-14(2)8-10-17(19)20-16/h3-12,15H,1-2H3
InChIKeyFATXBTKGJUJEDG-UHFFFAOYSA-N
MW292.32 g/mol
LogP4.34
Rot. Bonds1

About 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine

10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine (PubChem CID 102041839) has the molecular formula C19H17OP and a molecular weight of 292.32 g/mol. Its IUPAC name is 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine.

Molecular Properties

Compound Name10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine
PubChem CID102041839
Molecular FormulaC19H17OP
Molecular Weight292.32 g/mol
Exact Mass292.10
IUPAC Name10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine
SMILESCc1ccc2c(c1)P(C1C=CC=C1)c1cc(C)ccc1O2
InChIInChI=1S/C19H17OP/c1-13-7-9-16-18(11-13)21(15-5-3-4-6-15)19-12-14(2)8-10-17(19)20-16/h3-12,15H,1-2H3
InChIKeyFATXBTKGJUJEDG-UHFFFAOYSA-N
XLogP4.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(4aR,9bR)-8-methyl-4a,9b-dihydrodibenzofuran
CID 146532547
2,8,10-trimethylphenoxazine
CID 20781562
10-[2,7-ditert-butyl-5-(2,8-dimethylphenoxaphosphinin-10-yl)-9,9-dimethylxanthen-4-yl]-2,8-dimethylphenoxaphosphinine
CID 101396272
2,8-dimethylphenoxathiine 10-oxide
CID 139056216
2,7-dimethyl-9-phenyl-9H-xanthene
CID 22643678
3-bromo-8-methylbenzo[b][1]benzoxepine
CID 174356517
5-methylbenzotrioxole
CID 147997120
5-methyl-2-(5-methyl-1,3,2-benzodioxaborol-2-yl)-1,3,2-benzodioxaborole
CID 15829533
3,8-dimethyl-5,6-diphenylbenzo[b][1]benzoxepine
CID 13167351
5-methyl-1,3-benzodioxole
CID 142082223
CID 134976957
CID 134976957
4-methyl-1-(5-methyl-2,3-dihydro-1-benzofuran-2-yl)pentan-2-amine
CID 66394102

Frequently Asked Questions

What is the IUPAC name of 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine?
The IUPAC name of 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine (CID 102041839) is 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine.
What is the SMILES notation for 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine?
The canonical SMILES for 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine is Cc1ccc2c(c1)P(C1C=CC=C1)c1cc(C)ccc1O2.
What is the InChIKey of 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine?
The InChIKey is FATXBTKGJUJEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17OP/c1-13-7-9-16-18(11-13)21(15-5-3-4-6-15)19-12-14(2)8-10-17(19)20-16/h3-12,15H,1-2H3.
What are the key properties of 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine?
10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine has a molecular weight of 292.32 g/mol, XLogP of 4.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-cyclopenta-2,4-dien-1-yl-2,8-dimethylphenoxaphosphinine is sourced from PubChem (CID 102041839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).