dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene

C20H21Cl2P — CID 161014735

IUPACdichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene
SMILESC.CC1=Cc2ccccc2C1.ClP(Cl)C1=Cc2ccccc2C1
InChIInChI=1S/C10H10.C9H7Cl2P.CH4/c1-8-6-9-4-2-3-5-10(9)7-8;10-12(11)9-5-7-3-1-2-4-8(7)6-9;/h2-6H,7H2,1H3;1-5H,6H2;1H4
InChIKeyTXORBJIDZHMNJO-UHFFFAOYSA-N
MW363.27 g/mol
LogP7.66
Rot. Bonds1

About dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene

dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene (PubChem CID 161014735) has the molecular formula C20H21Cl2P and a molecular weight of 363.27 g/mol. Its IUPAC name is dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene.

Molecular Properties

Compound Namedichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene
PubChem CID161014735
Molecular FormulaC20H21Cl2P
Molecular Weight363.27 g/mol
Exact Mass362.08
IUPAC Namedichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene
SMILESC.CC1=Cc2ccccc2C1.ClP(Cl)C1=Cc2ccccc2C1
InChIInChI=1S/C10H10.C9H7Cl2P.CH4/c1-8-6-9-4-2-3-5-10(9)7-8;10-12(11)9-5-7-3-1-2-4-8(7)6-9;/h2-6H,7H2,1H3;1-5H,6H2;1H4
InChIKeyTXORBJIDZHMNJO-UHFFFAOYSA-N
XLogP7.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.27
LogP ≤ 57.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-methyl-1H-indene
CID 54388135
dilithium;hydride;2-methyl-1H-indene
CID 174389256
2-methyl-1H-indene;titanium(3+);trichloride
CID 157408587
ditert-butyl(1H-inden-2-yl)phosphane
CID 21095963
dibutyl(1H-inden-2-yl)phosphane
CID 21096004
cyclohexyl-bis(1H-inden-2-yl)phosphane
CID 21095205
2-methyl-1H-phenalene
CID 71398400
CID 143131255
CID 143131255
2-methylselanyl-1H-indene
CID 11041997
2,5-dimethyl-1H-indene;2,6-dimethyl-1H-indene
CID 90832270
3-methyl-1H-naphthalen-2-one;molecular hydrogen
CID 145302214
1-(2-methyl-1H-inden-5-yl)naphthalene
CID 54474031

Frequently Asked Questions

What is the IUPAC name of dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene?
The IUPAC name of dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene (CID 161014735) is dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene.
What is the SMILES notation for dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene?
The canonical SMILES for dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene is C.CC1=Cc2ccccc2C1.ClP(Cl)C1=Cc2ccccc2C1.
What is the InChIKey of dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene?
The InChIKey is TXORBJIDZHMNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10.C9H7Cl2P.CH4/c1-8-6-9-4-2-3-5-10(9)7-8;10-12(11)9-5-7-3-1-2-4-8(7)6-9;/h2-6H,7H2,1H3;1-5H,6H2;1H4.
What are the key properties of dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene?
dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene has a molecular weight of 363.27 g/mol, XLogP of 7.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(1H-inden-2-yl)phosphane;methane;2-methyl-1H-indene is sourced from PubChem (CID 161014735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).