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MorDalphos

CAT: 0926-MZB58812-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-MZB58812-02Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1237588-12-3
MDL Number
MFCD17018759
Molecular Formula
C30H42NOP
Molecular Weight
463.63 g/mol
Controlled
No

Chemical Information

4-(2-(Di(adamantan-1-yl)phosphino)phenyl)morpholine
CAS Number1237588-12-3
PubChem CID46848051
IUPAC Namebis(1-adamantyl)-(2-morpholin-4-ylphenyl)phosphane
Molecular FormulaC30H42NOP
Molecular Weight463.6
XLogP6.6
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count33
Formal Charge0
Complexity632
SMILES
C1COCCN1C2=CC=CC=C2P(C34CC5CC(C3)CC(C5)C4)C67CC8CC(C6)CC(C8)C7
InChI
InChI=1S/C30H42NOP/c1-2-4-28(27(3-1)31-5-7-32-8-6-31)33(29-15-21-9-22(16-29)11-23(10-21)17-29)30-18-24-12-25(19-30)14-26(13-24)20-30/h1-4,21-26H,5-20H2
InChIKey
CCBRRSUORFMQCZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2-(Di(adamantan-1-yl)phosphino)phenyl)morpholine
CAS: 1237588-12-3
CID: 46848051
Formula: C30H42NOP
MW: 463.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight463.6
XLogP36.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass463.30040196
Monoisotopic Mass463.30040196
Topological Polar Surface Area12.5 Ų
Heavy Atom Count33
Formal Charge0
Complexity632
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
IN12468-01MorDalPhos Pd G4
IN11789-01MorDalphos Pd G3

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