Ceftaroline Fosamil Impurity 17

CAT: 1596-AR-C02047-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C02047-01Size:10 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1427207-46-2

Synonyms

4- (1-methylpyridin-1-ium-4-yl) thiazole-2-thiolate

Molecular Formula

C9H8N2S2

Molecular Weight

208.3

API Name

Ceftaroline Fosamil

Chemical Information

(4-(N-Methylpyridium-4-yl)-1,3-thiazol-2-yl)thiolate

CAS Number	1427207-46-2
PubChem CID	71511048
IUPAC Name	4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazole-2-thiolate
Molecular Formula	C9H8N2S2
Molecular Weight	208.3
XLogP	2.2
Topological Polar Surface Area	46
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	169

SMILES

C[N+]1=CC=C(C=C1)C2=CSC(=N2)[S-]

InChI

InChI=1S/C9H8N2S2/c1-11-4-2-7(3-5-11)8-6-13-9(12)10-8/h2-6H,1H3

InChIKey

KLYZRPWWEZXDGQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1427207-46-2

CID: 71511048

Formula: C9H8N2S2

MW: 208.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	208.3
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	208.01289061
Monoisotopic Mass	208.01289061
Topological Polar Surface Area	46 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	169
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-Z00978-01	Ceftaroline Fosamil Impurity
AR-C02046-01	Ceftaroline Fosamil Impurity 16
AR-C02044-01	Ceftaroline Fosamil Impurity 14
AR-C02043-01	Ceftaroline Fosamil Impurity 13
AR-C02042-01	Ceftaroline Fosamil Impurity 12
AR-C06769-01	Ceftaroline Fosamil Impurity 31
AR-C06777-01	Ceftaroline Fosamil Impurity 25 and Ceftaroline Fosamil Impurity 26 (Equilibrium Form)
AR-C02038-01	Ceftaroline Fosamil Impurity 8
AR-C02052-01	Ceftaroline Fosamil Impurity 21
AR-C02048-01	Ceftaroline Fosamil Impurity 18

Catalog	Name
RM-C061901-01	Ceftaroline Fosamil Impurity A
RM-C061922-01	Ceftaroline Fosamil Impurity 12
RM-C061921-01	Ceftaroline Fosamil Impurity 11
RM-C061914-01	Ceftaroline Fosamil Impurity 4
RM-C061927-01	Ceftaroline Fosamil Impurity 17
RM-C061916-01	Ceftaroline Fosamil Impurity 6
RM-C061928-01	Ceftaroline Fosamil Impurity 18
RM-C061925-01	Ceftaroline Fosamil Impurity 15
RM-C061923-01	Ceftaroline Fosamil Impurity 13
RM-C061905-01	Ceftaroline Fosamil Impurity E