(3,4-dibutyl-2-methylphenoxy)phosphane

C15H25OP — CID 91430477

IUPAC(3,4-dibutyl-2-methylphenoxy)phosphane
SMILESCCCCc1ccc(OP)c(C)c1CCCC
InChIInChI=1S/C15H25OP/c1-4-6-8-13-10-11-15(16-17)12(3)14(13)9-7-5-2/h10-11H,4-9,17H2,1-3H3
InChIKeyGBLRRXPOTPYFAI-UHFFFAOYSA-N
MW252.34 g/mol
LogP4.85
Rot. Bonds7

About (3,4-dibutyl-2-methylphenoxy)phosphane

(3,4-dibutyl-2-methylphenoxy)phosphane (PubChem CID 91430477) has the molecular formula C15H25OP and a molecular weight of 252.34 g/mol. Its IUPAC name is (3,4-dibutyl-2-methylphenoxy)phosphane.

Molecular Properties

Compound Name(3,4-dibutyl-2-methylphenoxy)phosphane
PubChem CID91430477
Molecular FormulaC15H25OP
Molecular Weight252.34 g/mol
Exact Mass252.16
IUPAC Name(3,4-dibutyl-2-methylphenoxy)phosphane
SMILESCCCCc1ccc(OP)c(C)c1CCCC
InChIInChI=1S/C15H25OP/c1-4-6-8-13-10-11-15(16-17)12(3)14(13)9-7-5-2/h10-11H,4-9,17H2,1-3H3
InChIKeyGBLRRXPOTPYFAI-UHFFFAOYSA-N
XLogP4.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 54.85
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

1,2,3,4-tetrabutylbenzene
CID 11220391
tris(2,3,4-tributylphenyl) borate
CID 68718164
(2,3-dibutylphenyl)phosphane
CID 19901991
1,2-dimethyl-3,4-dioctylbenzene
CID 175311687
1,3-dibutyl-2,4-dimethoxybenzene
CID 162495747
dibutyl-[dibutyl-(3-ethyl-2-methyl-4-propylphenoxy)stannyl]oxy-(3-ethyl-2-methyl-4-propylphenoxy)stannane
CID 67502370
1,2,3-tributylbenzene;hydrate
CID 172716323
(2-octylphenoxy)phosphane
CID 163637323
(2,3,4-tributylphenyl) (2,3,4-trimethylphenyl) carbonate
CID 67180491
2,3-dimethyl-1,4-dipentylbenzene
CID 54478491
2,3,4-tris(2,3,4-tributylphenoxy)phenol
CID 67178539
3-benzyl-1,2-dibutyl-4-methoxybenzene
CID 70537049

Frequently Asked Questions

What is the IUPAC name of (3,4-dibutyl-2-methylphenoxy)phosphane?
The IUPAC name of (3,4-dibutyl-2-methylphenoxy)phosphane (CID 91430477) is (3,4-dibutyl-2-methylphenoxy)phosphane.
What is the SMILES notation for (3,4-dibutyl-2-methylphenoxy)phosphane?
The canonical SMILES for (3,4-dibutyl-2-methylphenoxy)phosphane is CCCCc1ccc(OP)c(C)c1CCCC.
What is the InChIKey of (3,4-dibutyl-2-methylphenoxy)phosphane?
The InChIKey is GBLRRXPOTPYFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25OP/c1-4-6-8-13-10-11-15(16-17)12(3)14(13)9-7-5-2/h10-11H,4-9,17H2,1-3H3.
What are the key properties of (3,4-dibutyl-2-methylphenoxy)phosphane?
(3,4-dibutyl-2-methylphenoxy)phosphane has a molecular weight of 252.34 g/mol, XLogP of 4.85, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dibutyl-2-methylphenoxy)phosphane is sourced from PubChem (CID 91430477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).