Home Other Building Blocks 2-[(pyrrolidin-3-yloxy)methyl]-1,3-thiazole

2-[(pyrrolidin-3-yloxy)methyl]-1,3-thiazole

CAS No.:
933702-08-0
Catalog Number:
AG01AF7A
Molecular Formula:
C8H12N2OS
Molecular Weight:
184.2587
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Product Description
Catalog Number:
AG01AF7A
Chemical Name:
2-[(pyrrolidin-3-yloxy)methyl]-1,3-thiazole
CAS Number:
933702-08-0
Molecular Formula:
C8H12N2OS
Molecular Weight:
184.2587
MDL Number:
MFCD23873225
IUPAC Name:
2-(pyrrolidin-3-yloxymethyl)-1,3-thiazole
InChI:
InChI=1S/C8H12N2OS/c1-2-9-5-7(1)11-6-8-10-3-4-12-8/h3-4,7,9H,1-2,5-6H2
InChI Key:
BNHTVWFUKJBIGY-UHFFFAOYSA-N
SMILES:
C1NCC(C1)OCc1nccs1
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.067g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.257g/mol
Monoisotopic Mass:
184.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties