methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane

C10H13OP — CID 143317684

IUPACmethyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane
SMILESCPc1cc(C)c2c(c1)CCO2
InChIInChI=1S/C10H13OP/c1-7-5-9(12-2)6-8-3-4-11-10(7)8/h5-6,12H,3-4H2,1-2H3
InChIKeyXXHWSIBPJKUIOB-UHFFFAOYSA-N
MW180.19 g/mol
LogP1.86
Rot. Bonds1

About methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane

methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane (PubChem CID 143317684) has the molecular formula C10H13OP and a molecular weight of 180.19 g/mol. Its IUPAC name is methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane.

Molecular Properties

Compound Namemethyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane
PubChem CID143317684
Molecular FormulaC10H13OP
Molecular Weight180.19 g/mol
Exact Mass180.07
IUPAC Namemethyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane
SMILESCPc1cc(C)c2c(c1)CCO2
InChIInChI=1S/C10H13OP/c1-7-5-9(12-2)6-8-3-4-11-10(7)8/h5-6,12H,3-4H2,1-2H3
InChIKeyXXHWSIBPJKUIOB-UHFFFAOYSA-N
XLogP1.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.19
LogP ≤ 51.86
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

2-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-2-amine
CID 117282534
ethane;7-methyl-2,3-dihydrofuro[3,2-c]pyridine
CID 163273368
ethane;7-methyl-2,3-dihydro-1-benzofuran
CID 91503061
ethane;7-fluoro-5-methyl-2,3-dihydro-1-benzofuran
CID 177214189
9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol
CID 102149497
[5-(3,5-dimethylphenyl)-2,3-dihydro-1-benzofuran-7-yl]methanamine
CID 104703299
5-ethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
CID 10058395
[1-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)cyclohexyl]methanamine
CID 117366230
5,7-difluoro-2,3-dihydro-1-benzofuran
CID 2736964
(5-chloro-2,3-dihydro-1-benzofuran-7-yl)-(2,4,6-trimethylphenyl)methanone
CID 104544697
5-methyl-7-(4-methylphenyl)-2,3-dihydro-1-benzofuran;propane
CID 142100880
5-methyl-7-(5-methylthiophen-2-yl)-2,3-dihydro-1-benzofuran
CID 23543547

Frequently Asked Questions

What is the IUPAC name of methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane?
The IUPAC name of methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane (CID 143317684) is methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane.
What is the SMILES notation for methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane?
The canonical SMILES for methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane is CPc1cc(C)c2c(c1)CCO2.
What is the InChIKey of methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane?
The InChIKey is XXHWSIBPJKUIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13OP/c1-7-5-9(12-2)6-8-3-4-11-10(7)8/h5-6,12H,3-4H2,1-2H3.
What are the key properties of methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane?
methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane has a molecular weight of 180.19 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane is sourced from PubChem (CID 143317684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).