Home > Compound List > Compound details
145214-57-9 molecular structure
click picture or here to close

(2-{2-[bis(furan-2-yl)phosphanyl]-6-methoxyphenyl}-3-methoxyphenyl)bis(furan-2-yl)phosphane

ChemBase ID: 140511
Molecular Formular: C30H24O6P2
Molecular Mass: 542.455482
Monoisotopic Mass: 542.10481175
SMILES and InChIs

SMILES:
COc1cccc(c1c1c(cccc1P(c1ccco1)c1ccco1)OC)P(c1ccco1)c1ccco1
Canonical SMILES:
COc1cccc(c1c1c(OC)cccc1P(c1ccco1)c1ccco1)P(c1ccco1)c1ccco1
InChI:
InChI=1S/C30H24O6P2/c1-31-21-9-3-11-23(37(25-13-5-17-33-25)26-14-6-18-34-26)29(21)30-22(32-2)10-4-12-24(30)38(27-15-7-19-35-27)28-16-8-20-36-28/h3-20H,1-2H3
InChIKey:
ABGYJVGTLXSMBM-UHFFFAOYSA-N

Cite this record

CBID:140511 http://www.chembase.cn/molecule-140511.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2-{2-[bis(furan-2-yl)phosphanyl]-6-methoxyphenyl}-3-methoxyphenyl)bis(furan-2-yl)phosphane
IUPAC Traditional name
(2-{2-[bis(furan-2-yl)phosphanyl]-6-methoxyphenyl}-3-methoxyphenyl)bis(furan-2-yl)phosphane
Synonyms
SL-A108-2
(S)-(-)-2,2′-Bis(di-2-furylphosphino)-6,6′-dimethoxy-1,1′-biphenyl
(S)-2-Furyl-MeOBIPHEP
(S)-(6,6′-Dimethoxybiphenyl-2,2′-diyl)bis(di-2-furylphosphine)
(R)-(6,6′-Dimethoxybiphenyl-2,2′-diyl)bis(di-2-furylphosphine)
SL-A108-1
(R)-(+)-2,2′-Bis(di-2-furylphosphino)-6,6′-dimethoxy-1,1′-biphenyl
(R)-2-Furyl-MeOBIPHEP
(S)-(+)-2,2′-双(二-2-呋喃基膦)-6,6′-二甲氧-1,1′-联苯
(S)-2-呋喃基-MeOBIPHEP
(S)-(6,6′-二甲氧基联苯-2,2′-二基)双(二-2-呋喃基膦)
(R)-(6,6′-二甲氧基联苯-2,2′-二基)双(二-2-呋喃基膦)
(R)-2-呋喃基-MeOBIPHEP
(R)-(+)-2,2′-双(二-2-呋喃基膦)-6,6′-二甲氧-1,1′-联苯
CAS Number
145214-57-9
145214-59-1
MDL Number
MFCD09753004
PubChem SID
162234755
PubChem CID
15307805

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 15307805 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 5.8532  LogD (pH = 7.4) 5.8532 
Log P 5.8532  Molar Refractivity 142.3172 cm3
Polarizability 57.562695 Å3 Polar Surface Area 71.02 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Purity
≥97% expand Show data source
Optical Purity
ee: ≥99% expand Show data source
Empirical Formula (Hill Notation)
C30H24O6P2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 29515 external link
General description
sold in collaboration with Solvias AG
Packaging
1, 5 g in glass bottle
100, 500 mg in glass bottle
Application
Atropisomeric MeOBIPHEP ligands
Sigma Aldrich - 29514 external link
General description
sold in collaboration with Solvias AG
Packaging
1, 5 g in glass bottle
100, 500 mg in glass bottle
Application
Atropisomeric MeOBIPHEP ligands

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle