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Reverse abasic phosphoramidite

CAT: 0013-GTR19279966-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19279966-02Size:50 mg
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Description
Reverse abasic phosphoramidite is a monomeric material used in nucleic acid synthesis.
CAS Number
401813-16-9
Smiles
C (O[C@@H]1[C@@H] (COP (N (C (C) C) C (C) C) OCCC#N) OCC1) (C2=CC=C (OC) C=C2) (C3=CC=C (OC) C=C3) C4=CC=CC=C4
Molecular Formula
C35H45N2O6P
Molecular Weight
620.73
Notes
For research use only.

Chemical Information

Reverse Abasic Phosphoramidite
CAS Number401813-16-9
PubChem CID10189291
IUPAC Name3-[[(2R,3S)-3-[bis(4-methoxyphenyl)-phenylmethoxy]oxolan-2-yl]methoxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
Molecular FormulaC35H45N2O6P
Molecular Weight620.7
XLogP6.1
Topological Polar Surface Area82.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count16
Heavy Atom Count44
Formal Charge0
Complexity829
SMILES
CC(C)N(C(C)C)P(OCCC#N)OC[C@@H]1[C@H](CCO1)OC(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC
InChI
InChI=1S/C35H45N2O6P/c1-26(2)37(27(3)4)44(41-23-10-22-36)42-25-34-33(21-24-40-34)43-35(28-11-8-7-9-12-28,29-13-17-31(38-5)18-14-29)30-15-19-32(39-6)20-16-30/h7-9,11-20,26-27,33-34H,10,21,23-25H2,1-6H3/t33-,34+,44?/m0/s1
InChIKey
WPNQXLQBMSUHFX-JUWSMZLESA-N
Chemical Structure
2D Structure
2D structure of Reverse Abasic Phosphoramidite
CAS: 401813-16-9
CID: 10189291
Formula: C35H45N2O6P
MW: 620.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight620.7
XLogP36.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count16
Exact Mass620.30152416
Monoisotopic Mass620.30152416
Topological Polar Surface Area82.4 Ų
Heavy Atom Count44
Formal Charge0
Complexity829
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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