AG00IMLR

98796-51-1 | Thymidine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-, 3'-[2-cyanoethylbis(1-methylethyl)phosphoramidite]

AG00IMLR

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CAS Number	98796-51-1
Catalog Number	AG00IMLR(AGN-PC-0W8MDH)
Chemical Name	Thymidine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-, 3'-[2-cyanoethylbis(1-methylethyl)phosphoramidite]
EC Number	685-410-3
IUPAC Name	3-[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
InChI	InChI=1S/C40H49N4O8P/c1-27(2)44(28(3)4)53(50-23-11-22-41)52-35-24-37(43-25-29(5)38(45)42-39(43)46)51-36(35)26-49-40(30-12-9-8-10-13-30,31-14-18-33(47-6)19-15-31)32-16-20-34(48-7)21-17-32/h8-10,12-21,25,27-28,35-37H,11,23-24,26H2,1-7H3,(H,42,45,46)/t35-,36+,37+,53?/m0/s1
InChI Key	UNOTXUFIWPRZJX-CEXSRUIHSA-N
MDL Number	MFCD00055063
Molecular Formula	C40H49N4O8P
Molecular Weight	744.8128
SMILES	C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)C[C@@H](O1)n1c(=O)[nH]c(=O)c(c1)C)(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1
Synonyms	98796-51-1, DMT-dT Phosphoramidite, 5'-O-DMT-thymidine 3'-CE phosphoramidite, DMT-dT Pharmadite(R), 5'-Dimethoxytrityl-3'-deoxythymidine 2'-[(2-cyanoethyl)-(N,N-diisopropyl)]-phosphoramidite, 5'-O-[Bis(4-Methoxyphenyl)phenylmethyl]-thymidine 3'-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite], DMT-dT Phosphoramidite, configured for ABI, DMT-dT Phosphoramidite, configured for MerMade, DMT-dT Phosphoramidite, configured for ??KTA(R) and OligoPilot(R), AK-54667, SCHEMBL2031822, CTK8F6953, DTXSID80433054, 5'-dimethoxytrityl-3'-deoxythymidine 2'-((2-cyanoethyl)-(n,n-diisopropyl))-phosphoramidite, MFCD00304709, ZINC97974531, AKOS022179889, AC-9559, ACN-027386, AN-4964, BC240835, R378, FT-0772185, 796D511, DMT-dT Phosphoramidite, configured for PerkinElmer, configured for Polygen, 3'-O-[2-Cyanoethoxy(diisopropylamino)phosphino]-5'-O-(4,4'-dimethoxytrityl)thymidine, DMT-dT Phosphoramidite, configured for PerkinElmer 8900, configured for Polygen, (2R,3S,5R)-2-((Bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite, 3-[[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]oxy-(diisopropylamino)phosphanyl]oxypropanenitrile, 5'-O-(4,4'-Dimethoxytrityl)-2'-deoxythymidine-3'-O-[o-(2-cyanoethyl)-N,N'-diisopropylphosphoramidite], 5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]-3'-O-{(2-cyanoethoxy)[di(propan-2-yl)amino]phosphanyl}thymidine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]- 3'-[2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] Thymidine, 5'-O-[Bis(4-Methoxyphenyl)phenylmethyl]-thymidine3'-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite], Thymidine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-, 3'-[2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite], Polysorbate 60, KBio2_005001, CID9940288, 5'-Dimethoxytrityl-3'-deoxythymidine2'-[ - ]-phosphoramidite, 5'-O-(4,4'-Dimethoxytrityl)-2'-deoxythymidine-3'-(2-cyanoethyl-n,n-diisopropyl)phosphoramidite, 99% - 5G 5g, 9005-67-8, Thymidine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-, 3'-[2-cyanoethyl bis(1-methylethyl)phosphoramidite],

Complexity	1240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	744.329g/mol
Formal Charge	0
Heavy Atom Count	53
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	744.826g/mol
Monoisotopic Mass	744.329g/mol
Rotatable Bond Count	17
Topological Polar Surface Area	132A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	5.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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