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N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine
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Name

N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine

 EINECS 264-776-4
CAS No. 64325-78-6 Density 1.32 g/cm3
PSA 129.85000 LogP 5.82590
Solubility CLEAR FAINT YELLOW SOLUTION AT 50MG/ML OF CHLOROFORM Melting Point 94 °C
Formula C38H35 N5 O6 Boiling Point 681.42°C (rough estimate)
Molecular Weight 657.726 Flash Point N/A
Transport Information N/A Appearance WHITE TO WHITE WITH A YELLOW CAST POWDER
Safety S22;S24/25 Risk Codes 20/21/22-36/37/38
Molecular Structure Molecular Structure of 64325-78-6 (N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine) Hazard Symbols Xn
Synonyms

Adenosine,N-benzoyl-5'-O-[a,a-bis(p-methoxyphenyl)benzyl]-2'-deoxy-(7CI); 5'-O-(Dimethoxytrityl)-N-benzoyldeoxyadenosine;5'-O-(Dimethoxytrityl)-N6-benzoyl-2'-deoxyadenosine;N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine;N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine;N6-Benzoyl-5'-O-(dimethoxytrityl)deoxyadenosine

Article Data 15

N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine Chemical Properties

Product Name: Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy- (CAS NO.64325-78-6)


Molecular Formula: C38H35N5O6
Molecular Weight: 657.71g/mol
Mol File: 64325-78-6.mol
EINECS: 264-776-4
Melting Point: 94 °C
Storage Temperature: -20°C
Density: 1.32 g/cm3
Surface Tension: 52.6 dyne/cm
XLogP3-AA: 4.8
H-Bond Donor: 2
H-Bond Acceptor: 9
Structure Descriptors of Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy- (CAS NO.64325-78-6):
  IUPAC Name: N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]purin-6-yl]benzamide
  Canonical SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(CC(O4)N5C=NC6=C5N=CN=C6NC(=O)C7=CC=CC=C7)O
  Isomeric SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OC[C@@H]4[C@H](C[C@@H](O4)N5C=NC6=C5N=CN=C6NC(=O)C7=CC=CC=C7)O
  InChI: InChI=1S/C38H35N5O6/c1-46-29-17-13-27(14-18-29)38(26-11-7-4-8-12-26,28-15-19-30(47-2)20-16-28)48-22-32-31(44)21-33(49-32)43-24-41-34-35(39-23-40-36(34)43)42-37(45)25-9-5-3-6-10-25/h3-20,23-24,31-33,44H,21-22H2,1-2H3,(H,39,40,42,45)/t31-,32+,33+/m0/s1
  InChIKey: LPICNYATEWGYHI-WIHCDAFUSA-N
Product Categories: Organics; Biochemistry; Nucleosides and their analogs; Nucleosides, Nucleotides & Related Reagents 

N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine Safety Profile

Safety Information of Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy- (CAS NO.64325-78-6):
Hazard Codes: XnHarmful
Risk Statements: 20/21/22-36/37/38  
20:  Harmful by inhalation 
21:  Harmful in contact with skin 
22:  Harmful if swallowed 
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin 
Safety Statements: 22-24/25-36-26
22:  Do not breathe dust 
24:  Avoid contact with skin 
25:  Avoid contact with eyes 
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing 
WGK Germany: 3
F: 1-3-10  

N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine Specification

 Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy- , its CAS NO. is 64325-78-6, the synonyms are DMBTA ; EINECS 264-776-4 ; N-Benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxyadenosine . 

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