AG00G3PL

817204-33-4 | 2'-deoxy-2'-fluoro-2'-C-methylcytidine

AG00G3PL

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CAS Number	817204-33-4
Catalog Number	AG00G3PL(AGN-PC-0OILFU)
Chemical Name	2'-deoxy-2'-fluoro-2'-C-methylcytidine
IUPAC Name	4-amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]pyrimidin-2-one
InChI	InChI=1S/C10H14FN3O4/c1-10(11)7(16)5(4-15)18-8(10)14-3-2-6(12)13-9(14)17/h2-3,5,7-8,15-16H,4H2,1H3,(H2,12,13,17)/t5-,7-,8-,10-/m1/s1
InChI Key	NYPIRLYMDJMKGW-VPCXQMTMSA-N
MDL Number	MFCD13176566
Molecular Formula	C10H14FN3O4
Molecular Weight	259.2343
SMILES	C[C@@]1(F)[C@H](O)[C@@H](CO)O[C@H]1N1C=CC(N)=NC1=O
UNII	05J68784G1
Synonyms	2'-deoxy-2'-fluoro-2'-C-methylcytidine, 2'-F-2'-C-MeC, 4-amino-(3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyltetrahydrofuran-2-yl)pyrimidin-2(1H)-one, PSI 6130, PSI-6130, PSI6130, PSI-6130, 817204-33-4, 2'-deoxy-2'-fluoro-2'-C-methylcytidine, 4-Amino-1-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyltetrahydrofuran-2-yl)pyrimidin-2(1H)-one, PSI 6130, Cytidine, 2'-deoxy-2'-fluoro-2'-methyl-, (2'R)-, PSI6130, UNII-05J68784G1, R-1656, 05J68784G1, A1-01395, 4-amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]pyrimidin-2-one, R 1656, SCHEMBL379121, AC1O5B17, CHEMBL223482, 2'-Fluoro-2'-C-methylcytidine, DTXSID10231287, NYPIRLYMDJMKGW-VPCXQMTMSA-N, 4-amino-1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]pyrimidin-2-one, AMX10216, BCP09351, MFCD13176566, RO5855, ZINC34082873, 2-deoxy-2-fluoro-2-C-methylcytidine, AKOS016009199, API0014097, CM14183, CS-0597, SB12050, AJ-86848, AK109452, HY-10165, SC-50499, R 1656; PSI 6130, AX8229275, ST24043181, cas:817204-33-4;PSI-6130, Cytidine, 2'-C-methyl-2'-Fluoro-2'-deoxy-, (2'R)-2'-deoxy-2'-fluoro-2'-methylcytidine, A11519, W-5552, 2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-2-fluoro-2-methyl-.beta.-D-ribofuranosyl)-, D00RFZ, PSI-6130-DP, PSI-6130-MP, PSI-6130-TP, 2'-F-2'-C-MeC, AIDS336151, ACN-029007, CID6481236, PS-6130, Hepatitis C virus therapy, Pharmasset/Roche, A3737, RO-4995855, 2/'-Deoxy-2/'-fluoro-2/'-C-methylcytidine, R-1479, C504520, 4-amino-(3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyltetrahydrofuran-2-yl)pyrimidin-2(1H)-one, 478182-28-4,

Complexity	427
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	259.097g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	259.237g/mol
Monoisotopic Mass	259.097g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	108A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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