Products for Research Use Only

Cefazolin Impurity E

CAT: 1299-RM-C062705-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-C062705-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
478494-71-2
Synonyms
(6R,7R) -7- (2- (1H-tetrazol-1-yl) acetamido) -3- (hydroxymethyl) -8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Formula
C11H12N6O5S
Molecular Weight
340.32
Target Alternative Name
Cefazolin
Product Name Synonym
(6R,7R) -7- (2- (1H-tetrazol-1-yl) acetamido) -3- (hydroxymethyl) -8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Chemical Information

Cefazolin 3-Hydroxymethyl Impurity
CAS Number478494-71-2
PubChem CID124584303
IUPAC Name(6R,7R)-3-(hydroxymethyl)-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular FormulaC11H12N6O5S
Molecular Weight340.32
XLogP-2.3
Topological Polar Surface Area176
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity583
SMILES
C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CN3C=NN=N3)C(=O)O)CO
InChI
InChI=1S/C11H12N6O5S/c18-2-5-3-23-10-7(9(20)17(10)8(5)11(21)22)13-6(19)1-16-4-12-14-15-16/h4,7,10,18H,1-3H2,(H,13,19)(H,21,22)/t7-,10-/m1/s1
InChIKey
YGQTUWKIILQPEL-GMSGAONNSA-N
Chemical Structure
2D Structure
2D structure of Cefazolin 3-Hydroxymethyl Impurity
CAS: 478494-71-2
CID: 124584303
Formula: C11H12N6O5S
MW: 340.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight340.32
XLogP3-2.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass340.05898868
Monoisotopic Mass340.05898868
Topological Polar Surface Area176 Ų
Heavy Atom Count23
Formal Charge0
Complexity583
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Popular Products