Cefazolin Impurity 50

CAT: 1299-RM-C062750-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-C062750-01Size:10 mg

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

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CAS Number

26240-90-4

Synonyms

Ethyl 2- (1H-tetrazol-1-yl) acetate

Molecular Formula

C5H8N4O2

Molecular Weight

156.14

Target Alternative Name

Cefazolin

Product Name Synonym

Ethyl 2- (1H-tetrazol-1-yl) acetate

Chemical Information

1H-Tetrazole-1-acetic acid, ethyl ester

CAS Number	26240-90-4
PubChem CID	14415264
IUPAC Name	ethyl 2-(tetrazol-1-yl)acetate
Molecular Formula	C5H8N4O2
Molecular Weight	156.14
XLogP	0
Topological Polar Surface Area	69.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	11
Formal Charge	0
Complexity	140

SMILES

CCOC(=O)CN1C=NN=N1

InChI

InChI=1S/C5H8N4O2/c1-2-11-5(10)3-9-4-6-7-8-9/h4H,2-3H2,1H3

InChIKey

XEMPQKCXNIIWSS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 26240-90-4

CID: 14415264

Formula: C5H8N4O2

MW: 156.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	156.14
XLogP3	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	156.06472551
Monoisotopic Mass	156.06472551
Topological Polar Surface Area	69.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	140
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