AG007A7I

362-76-5 | 2-Amino-9-((3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-1H-purin-6(9H)-one

AG007A7I

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CAS Number	362-76-5
Catalog Number	AG007A7I(AGN-PC-0RBYY2)
Chemical Name	2-Amino-9-((3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-1H-purin-6(9H)-one
EC Number	206-651-9
IUPAC Name	9-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-2-amino-1H-purin-6-one
InChI	InChI=1S/C13H17N5O5/c1-13(2)22-7-5(3-19)21-11(8(7)23-13)18-4-15-6-9(18)16-12(14)17-10(6)20/h4-5,7-8,11,19H,3H2,1-2H3,(H3,14,16,17,20)/t5-,7-,8-,11-/m1/s1
InChI Key	XKPDAYWPKILAMO-IOSLPCCCSA-N
MDL Number	MFCD00057081
Molecular Formula	C13H17N5O5
Molecular Weight	323.3046
SMILES	O=C1NC(N)=NC2=C1N=CN2[C@@H]3O[C@H](CO)[C@]4([H])[C@@]3([H])OC(C)(C)O4
Synonyms	2',3'-O-Isopropylideneguanosine, 362-76-5, 2-Amino-9-((3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-1H-purin-6(9H)-one, 2',3'-O-(1-Methylethylidene)guanosine, XKPDAYWPKILAMO-IOSLPCCCSA-N, MFCD00057081, AK142174, 2',3'-O-(1-Methylethylidene)-guanosine, 9-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-2-amino-3H-purin-6-one, EINECS 206-651-9, AC1L2RA8, AC1Q6O98, SCHEMBL1762946, Jsp006474, 2', 3'-isopropylideneguanosine, ZINC5762619, 2'-O,3'-O-Isopropylideneguanosine, 4911AH, CI-089, AKOS015896943, CS-W008240, DS-7496, 2',3'-O-(1-Methylethyliden)-guanosin, AJ-54793, AN-44530, AX8002397, Guanosine, 2',3'-O-(1-methylethylidene)-, 362O765, A823782, 2', 3'-Isopropylideneguanosine ( 2',3'-Ipr-Guo ), 9-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-2-azanyl-3H-purin-6-one, 2',3'-Isopropylideneguanosine, C13H17N5O5, AR-1D2800, CID101661, C13-H17-N5-O5, 2/',3/'-O-(1-Methylethylidene)guanosine, 2',3'-O-Isopropylideneguanosine, 98% - 25G 25g, 37593-02-5,

Complexity	555
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	323.123g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	323.309g/mol
Monoisotopic Mass	323.123g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	133A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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