Ganciclovir EP Impurity C

CAT: 1299-RM-G140903-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-G140903-01Size:10 mg

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CAS Number

108436-36-8

Synonyms

2-amino-9- (((1-chloro-3-hydroxypropan-2-yl) oxy) methyl) -1H-purin-6 (9H) -one

Molecular Formula

C9H12ClN5O3

Molecular Weight

273.68

Target Alternative Name

Ganciclovir

Product Name Synonym

2-amino-9- (((1-chloro-3-hydroxypropan-2-yl) oxy) methyl) -1H-purin-6 (9H) -one

Chemical Information

2-Amino-9-(((1RS)-2-chloro-1-(hydroxymethyl)ethoxy)methyl)-1,9-dihydro-6H-purin-6-one

CAS Number	108436-36-8
PubChem CID	135480724
IUPAC Name	2-amino-9-[(1-chloro-3-hydroxypropan-2-yl)oxymethyl]-1H-purin-6-one
Molecular Formula	C9H12ClN5O3
Molecular Weight	273.68
XLogP	-1.3
Topological Polar Surface Area	115
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	353

SMILES

C1=NC2=C(N1COC(CO)CCl)N=C(NC2=O)N

InChI

InChI=1S/C9H12ClN5O3/c10-1-5(2-16)18-4-15-3-12-6-7(15)13-9(11)14-8(6)17/h3,5,16H,1-2,4H2,(H3,11,13,14,17)

InChIKey

FQZPLTGJIGCMPY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 108436-36-8

CID: 135480724

Formula: C9H12ClN5O3

MW: 273.68

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	273.68
XLogP3	-1.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	273.0628670
Monoisotopic Mass	273.0628670
Topological Polar Surface Area	115 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	353
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-G140901-01	Ganciclovir EP Impurity A
RM-G140904-01	Ganciclovir EP Impurity D
RM-G140902-01	Ganciclovir EP Impurity B
RM-G140908-01	Ganciclovir EP Impurity H
RM-G140905-01	Ganciclovir EP Impurity E
RM-G140910-01	Ganciclovir EP Impurity J
RM-G140909-01	Ganciclovir EP Impurity I
RM-G140906-01	Ganciclovir EP Impurity F; Valaciclovir EP Impurity A; Aciclovir EP Impurity B
RM-G140935-01	Ganciclovir Impurity 35; Valganciclovir EP Impurity O
RM-G140928-01	Ganciclovir Impurity 28 (Ganciclovir Diacetate)

Catalog	Name
AR-G01106-01	Ganciclovir Dipropionate (Ganciclovir Impurity I)
AR-G01107-01	Ganciclovir EP Impurity E (iso-Ganciclovir)
sc-471484	Ganciclovir Dimether Impurity
AR-G01116-01	Ganciclovir Impurity H
AR-G01108-01	Ganciclovir Impurity D
AR-G01117-01	Ganciclovir Impurity I
AR-G02044-01	Ganciclovir Impurity 9
AR-G02043-01	Ganciclovir Impurity 8
AR-G02051-01	Ganciclovir Impurity 16
AR-G02050-01	Ganciclovir Impurity 15