Home Carboxys ethyl 2-(pyrrolidin-2-yl)-1,3-thiazole-4-carboxylate hydrobromide

ethyl 2-(pyrrolidin-2-yl)-1,3-thiazole-4-carboxylate hydrobromide

CAS No.:
1798725-69-5
Catalog Number:
AG01BDCC
Molecular Formula:
C10H15BrN2O2S
Molecular Weight:
307.2073
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Product Description
Catalog Number:
AG01BDCC
Chemical Name:
ethyl 2-(pyrrolidin-2-yl)-1,3-thiazole-4-carboxylate hydrobromide
CAS Number:
1798725-69-5
Molecular Formula:
C10H15BrN2O2S
Molecular Weight:
307.2073
MDL Number:
MFCD28012455
IUPAC Name:
ethyl 2-pyrrolidin-2-yl-1,3-thiazole-4-carboxylate;hydrobromide
InChI:
InChI=1S/C10H14N2O2S.BrH/c1-2-14-10(13)8-6-15-9(12-8)7-4-3-5-11-7;/h6-7,11H,2-5H2,1H3;1H
InChI Key:
JJHURWNVNPTRCK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1csc(n1)C1CCCN1.Br
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.004g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
307.206g/mol
Monoisotopic Mass:
306.004g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties