Home Amines 5547-29-5
5547-29-5,MFCD01682023
Catalog No.:AA01CB90

5547-29-5 | 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt,(6R-trans)-

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Technical Information
Catalog Number:
AA01CB90
Chemical Name:
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt,(6R-trans)-
CAS Number:
5547-29-5
Molecular Formula:
C14H13N2NaO5S2
Molecular Weight:
376.3832
MDL Number:
MFCD01682023
SMILES:
C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-])CO.[Na+]
Properties
Computed Properties
 
Complexity:
586  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  

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Tags:5547-29-5 Molecular Formula|5547-29-5 MDL|5547-29-5 SMILES|5547-29-5 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-(hydroxymethyl)-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt,(6R-trans)-