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2060063-89-8

2060063-89-8 | 2-cyclobutyl-1,3-oxazole-4-carbothioamide

CAS No: 2060063-89-8 Catalog No: AG01BRY6 MDL No:MFCD30535954

Product Description

Catalog Number:
AG01BRY6
Chemical Name:
2-cyclobutyl-1,3-oxazole-4-carbothioamide
CAS Number:
2060063-89-8
Molecular Formula:
C8H10N2OS
Molecular Weight:
182.2428
MDL Number:
MFCD30535954
IUPAC Name:
2-cyclobutyl-1,3-oxazole-4-carbothioamide
InChI:
InChI=1S/C8H10N2OS/c9-7(12)6-4-11-8(10-6)5-2-1-3-5/h4-5H,1-3H2,(H2,9,12)
InChI Key:
RAWDHAZNVIUKCY-UHFFFAOYSA-N
SMILES:
NC(=S)c1coc(n1)C1CCC1

Properties

Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.241g/mol
Monoisotopic Mass:
182.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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