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DMT-dG (dmf) -CE-Phosphoramidite

CAT: 1489-D8840-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:1489-D8840-01Size:1 g
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CAS Number
330628-04-1
Purity
≥98%

Chemical Information

DMF-dG Phosphoramidite
CAS Number330628-04-1
PubChem CID136334904
IUPAC NameN'-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyoxolan-2-yl]-6-oxo-1H-purin-2-yl]-N,N-dimethylmethanimidamide
Molecular FormulaC43H53N8O7P
Molecular Weight824.9
XLogP5.5
Topological Polar Surface Area157
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count19
Heavy Atom Count59
Formal Charge0
Complexity1410
SMILES
CC(C)N(C(C)C)P(OCCC#N)O[C@H]1C[C@@H](O[C@@H]1COC(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)N5C=NC6=C5N=C(NC6=O)/N=C/N(C)C
InChI
InChI=1S/C43H53N8O7P/c1-29(2)51(30(3)4)59(56-24-12-23-44)58-36-25-38(50-28-45-39-40(50)47-42(48-41(39)52)46-27-49(5)6)57-37(36)26-55-43(31-13-10-9-11-14-31,32-15-19-34(53-7)20-16-32)33-17-21-35(54-8)22-18-33/h9-11,13-22,27-30,36-38H,12,24-26H2,1-8H3,(H,47,48,52)/b46-27+/t36-,37+,38+,59?/m0/s1
InChIKey
YRQAXTCBMPFGAN-UNHDIWNRSA-N
Chemical Structure
2D Structure
2D structure of DMF-dG Phosphoramidite
CAS: 330628-04-1
CID: 136334904
Formula: C43H53N8O7P
MW: 824.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight824.9
XLogP35.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count19
Exact Mass824.37748306
Monoisotopic Mass824.37748306
Topological Polar Surface Area157 Ų
Heavy Atom Count59
Formal Charge0
Complexity1410
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes