butyl bis(2-tert-butylphenyl) phosphite

C24H35O3P — CID 141233548

IUPACbutyl bis(2-tert-butylphenyl) phosphite
SMILESCCCCOP(Oc1ccccc1C(C)(C)C)Oc1ccccc1C(C)(C)C
InChIInChI=1S/C24H35O3P/c1-8-9-18-25-28(26-21-16-12-10-14-19(21)23(2,3)4)27-22-17-13-11-15-20(22)24(5,6)7/h10-17H,8-9,18H2,1-7H3
InChIKeyZAWBQWCCSRWCHW-UHFFFAOYSA-N
MW402.52 g/mol
LogP7.78
Rot. Bonds8

About butyl bis(2-tert-butylphenyl) phosphite

butyl bis(2-tert-butylphenyl) phosphite (PubChem CID 141233548) has the molecular formula C24H35O3P and a molecular weight of 402.52 g/mol. Its IUPAC name is butyl bis(2-tert-butylphenyl) phosphite.

Molecular Properties

Compound Namebutyl bis(2-tert-butylphenyl) phosphite
PubChem CID141233548
Molecular FormulaC24H35O3P
Molecular Weight402.52 g/mol
Exact Mass402.23
IUPAC Namebutyl bis(2-tert-butylphenyl) phosphite
SMILESCCCCOP(Oc1ccccc1C(C)(C)C)Oc1ccccc1C(C)(C)C
InChIInChI=1S/C24H35O3P/c1-8-9-18-25-28(26-21-16-12-10-14-19(21)23(2,3)4)27-22-17-13-11-15-20(22)24(5,6)7/h10-17H,8-9,18H2,1-7H3
InChIKeyZAWBQWCCSRWCHW-UHFFFAOYSA-N
XLogP7.78
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.52
LogP ≤ 57.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2,3-ditert-butylphenyl) didodecyl phosphite
CID 20512200
(2-tert-butylphenyl) bis(2-nonylphenyl) phosphite
CID 69425077
(2-bromophenyl) dibutyl phosphite
CID 134288649
1-tert-butyl-2-heptoxybenzene
CID 64763672
[2-[[2-bis(2-tert-butylphenoxy)phosphanyloxyphenyl]-dimethylsilyl]phenyl] bis(2-tert-butylphenyl) phosphite
CID 58931579
(2-tert-butylphenoxy)-di(propan-2-yl)phosphane
CID 11346160
(2-tert-butylphenyl) 2-ethylhexyl hydrogen phosphite
CID 54359277
bis(2-tert-butylphenyl) (2,5-ditert-butylphenyl) phosphite
CID 54014526
(4-tert-butylphenyl) didodecyl phosphite
CID 59608946
(2-tert-butylphenyl) dihydroxyphosphanyl hydrogen phosphite
CID 154036014
N-[2-[2-(2-tert-butylphenoxy)ethoxy]ethyl]butan-1-amine
CID 2280746
diphenyl 13-tridecoxytridecyl phosphite
CID 101311954

Frequently Asked Questions

What is the IUPAC name of butyl bis(2-tert-butylphenyl) phosphite?
The IUPAC name of butyl bis(2-tert-butylphenyl) phosphite (CID 141233548) is butyl bis(2-tert-butylphenyl) phosphite.
What is the SMILES notation for butyl bis(2-tert-butylphenyl) phosphite?
The canonical SMILES for butyl bis(2-tert-butylphenyl) phosphite is CCCCOP(Oc1ccccc1C(C)(C)C)Oc1ccccc1C(C)(C)C.
What is the InChIKey of butyl bis(2-tert-butylphenyl) phosphite?
The InChIKey is ZAWBQWCCSRWCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35O3P/c1-8-9-18-25-28(26-21-16-12-10-14-19(21)23(2,3)4)27-22-17-13-11-15-20(22)24(5,6)7/h10-17H,8-9,18H2,1-7H3.
What are the key properties of butyl bis(2-tert-butylphenyl) phosphite?
butyl bis(2-tert-butylphenyl) phosphite has a molecular weight of 402.52 g/mol, XLogP of 7.78, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butyl bis(2-tert-butylphenyl) phosphite is sourced from PubChem (CID 141233548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).