Home > Compound List > Compound details
97858-62-3 molecular structure
click picture or here to close

(2-methoxyphenyl)({2-[(2-methoxyphenyl)(phenyl)phosphanyl]ethyl})phenylphosphane

ChemBase ID: 141526
Molecular Formular: C28H28O2P2
Molecular Mass: 458.468242
Monoisotopic Mass: 458.1564534
SMILES and InChIs

SMILES:
COc1ccccc1P(CCP(c1ccccc1)c1ccccc1OC)c1ccccc1
Canonical SMILES:
COc1ccccc1P(c1ccccc1)CCP(c1ccccc1OC)c1ccccc1
InChI:
InChI=1S/C28H28O2P2/c1-29-25-17-9-11-19-27(25)31(23-13-5-3-6-14-23)21-22-32(24-15-7-4-8-16-24)28-20-12-10-18-26(28)30-2/h3-20H,21-22H2,1-2H3
InChIKey:
QKZWXPLBVCKXNQ-UHFFFAOYSA-N

Cite this record

CBID:141526 http://www.chembase.cn/molecule-141526.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2-methoxyphenyl)({2-[(2-methoxyphenyl)(phenyl)phosphanyl]ethyl})phenylphosphane
IUPAC Traditional name
dipamp
Synonyms
(1S,2S)-(+)-Bis[(2-methoxyphenyl)phenylphosphino]ethane
(S,S)-1,2-Bis[(2-methoxyphenyl)(phenylphosphino)]ethane
(S,S)-1,2-Ethanediylbis[(2-methoxyphenyl)phenylphosphine]
(S,S)-DIPAMP
(R,R)-1,2-Bis[(2-methoxyphenyl)(phenylphosphino)]ethane
(R,R)-1,2-Ethanediylbis[(2-methoxyphenyl)phenylphosphine]
(R,R)-Ethylenebis[(2-methoxyphenyl)phenylphosphine]
[(1R,2R)-(-)-Bis[(2-methoxyphenyl)phenylphosphino]ethane]
(R,R)-DIPAMP
(1R,2R)-(-)-Bis[(2-methoxyphenyl)phenylphosphino]ethane
(1S,2S)-(+)-1,2-双[(2-甲氧基苯基)苯基磷]乙烷
(S,S)-1,2-乙二基双[(2-甲氧苯基)苯膦]
(S,S)-1,2-双[(2-甲氧基苯基)苯基膦基]乙烷
(R,R)-乙烯二[(2-甲氧基苯基)苯基膦]
(R,R)-1,2-乙烷二基双[(2-甲氧基苯基)苯基膦]
(R,R)-1,2-双[(2-甲氧基苯基)(苯基膦基)]乙烷
[(1R,2R)-(-)-双[(2-甲氧基苯基)苯基膦]乙烷]
(R,R)-双[(2-甲氧基苯基)苯基磷]乙烷
(S,S)-双[(2-甲氧基苯基)苯基磷]乙烷
CAS Number
97858-62-3
55739-58-7
MDL Number
MFCD05863547
MFCD05863546
PubChem SID
24869913
24869914
162235760
PubChem CID
2734557

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 6.3074  LogD (pH = 7.4) 6.3074 
Log P 6.3074  Molar Refractivity 134.7592 cm3
Polarizability 53.319164 Å3 Polar Surface Area 18.46 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
101-105 °C(lit.) expand Show data source
101-105°C expand Show data source
102-106 °C(lit.) expand Show data source
Optical Rotation
[α]20/D -88°, c = 1% in chloroform expand Show data source
[α]22/D +82, c = 1 in chloroform expand Show data source
[α]22/D -81°, c = 1 in chloroform expand Show data source
+84 (c=1 in chloroform) expand Show data source
-83 (c=1 in chloroform) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335-H413 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Purity
≥95% expand Show data source
95% expand Show data source
97% expand Show data source
Linear Formula
[CH3OC6H4P(C6H5)CH2]2 expand Show data source
[CH3OC6H4P(C6H5)CH2-]2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 697753 external link
Packaging
100, 500 mg in glass bottle
Legal Information
Sold in collaboration with Celtic Catalysts for research purposes only.
Sigma Aldrich - 461865 external link
Packaging
1 g in glass bottle
500 mg in glass bottle
Sigma Aldrich - 697761 external link
Packaging
100, 500 mg in glass bottle
Legal Information
Sold in collaboration with Celtic Catalysts for research purposes only.
Sigma Aldrich - 461873 external link
Packaging
1 g in glass bottle
250 mg in glass bottle

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