Ticarcillin EP Impurity C

CAT: 1596-AR-T02205-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T02205-02Size:25 Units

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CAS Number

21080-92-2

Synonyms

2- (thiophen-3-yl) malonic acid;2- (3-Thienyl) malonic Acid; 3-Thienylmalonic Acid; Ticarcillin EP Impurity C

Molecular Formula

C7H6O4S

Molecular Weight

186.19

API Name

Ticarcillin Sodium

Chemical Information

2-(Thiophen-3-yl)propanedioic acid

CAS Number	21080-92-2
PubChem CID	88782
IUPAC Name	2-thiophen-3-ylpropanedioic acid
Molecular Formula	C7H6O4S
Molecular Weight	186.19
XLogP	0.9
Topological Polar Surface Area	103
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	190

SMILES

C1=CSC=C1C(C(=O)O)C(=O)O

InChI

InChI=1S/C7H6O4S/c8-6(9)5(7(10)11)4-1-2-12-3-4/h1-3,5H,(H,8,9)(H,10,11)

InChIKey

GCOOGCQWQFRJEK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 21080-92-2

CID: 88782

Formula: C7H6O4S

MW: 186.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	186.19
XLogP3	0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	185.99867984
Monoisotopic Mass	185.99867984
Topological Polar Surface Area	103 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	190
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-T02204-01	Ticarcillin EP Impurity B
AR-T02203-01	Ticarcillin Sodium EP Impurity A
AR-T05151-01	Ticarcillin Sodium EP Impurity A Sodium Salt
AR-T02206-01	Ticarcillin EP Impurity D Disodium Salt (Mixture of Diastereomers)
AR-T05150-01	Ticarcillin EP Impurity D Disodium Salt (Mixture of Diastereomers)
AR-T05149-01	Ticarcillin Impurity 1
AR-P30581-01	Pemetrexed EP Impurity B and Pemetrexed EP Impurity C
AR-M03381-01	Morphine EP Impurity C (Codeine EP Impurity L)
AR-T05027-01	Liothyronine EP Impurity C-13C6 (Levothyroxine EP Impurity C-13C6)
AR-T02885-01	Tretinoin EP Impurity C (Isotretinoin EP Impurity C) (90% Purity)