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102691-36-1 | Phosphorodiamidous acid, N,N,N',N'-tetrakis(1-methylethyl)-, 2-cyanoethyl ester
CAS No: 102691-36-1 Catalog No: AG00084L MDL No:MFCD00012213
Product Description
Catalog Number:
AG00084L
Chemical Name:
Phosphorodiamidous acid, N,N,N',N'-tetrakis(1-methylethyl)-, 2-cyanoethyl ester
CAS Number:
102691-36-1
Molecular Formula:
C15H32N3OP
Molecular Weight:
301.4078
MDL Number:
MFCD00012213
IUPAC Name:
3-bis[di(propan-2-yl)amino]phosphanyloxypropanenitrile
InChI:
InChI=1S/C15H32N3OP/c1-12(2)17(13(3)4)20(19-11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3
InChI Key:
RKVHNYJPIXOHRW-UHFFFAOYSA-N
SMILES:
CC(N(P(N(C(C)C)C(C)C)OCCC#N)C(C)C)C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.228g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.415g/mol
Monoisotopic Mass:
301.228g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
39.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Convenient synthesis of a propargylated cyclic (3'-5') diguanylic acid and its 'click' conjugation to a biotinylated azide. | Bioconjugate chemistry 20101117 |
| DNA adducts of acrolein: site-specific synthesis of an oligodeoxynucleotide containing 6-hydroxy-5,6,7,8-tetrahydropyrimido[1,2-a]purin-10(3H)-one, an acrolein adduct of guanine. | Chemical research in toxicology 20020501 |
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