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100019-65-6

100019-65-6 | Thymidine, α,α,α-trifluoro-, cyclic 3',5'-(hydrogen phosphate), monoammonium salt (9CI)

CAS No: 100019-65-6 Catalog No: AG0000B8 MDL No:

Product Description

Catalog Number:
AG0000B8
Chemical Name:
Thymidine, α,α,α-trifluoro-, cyclic 3',5'-(hydrogen phosphate), monoammonium salt (9CI)
CAS Number:
100019-65-6
IUPAC Name:
azanium;6-[(6R)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-5-(trifluoromethyl)-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C10H10F3N2O7P.H3N/c11-10(12,13)6-7(14-9(17)15-8(6)16)4-1-3-5(21-4)2-20-23(18,19)22-3;/h3-5H,1-2H2,(H,18,19)(H2,14,15,16,17);1H3/t3?,4-,5?;/m1./s1
InChI Key:
OMOQHMUFLPJQEB-LOFQCAQHSA-N

Properties

Complexity:
641  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
375.044g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
375.197g/mol
Monoisotopic Mass:
375.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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