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1251360-94-7

1251360-94-7 | 1-(2-cyclopropyl-4-methyl-1,3-thiazol-5-yl)ethan-1-one

CAS No: 1251360-94-7 Catalog No: AG019SH0 MDL No:MFCD14587794

Product Description

Catalog Number:
AG019SH0
Chemical Name:
1-(2-cyclopropyl-4-methyl-1,3-thiazol-5-yl)ethan-1-one
CAS Number:
1251360-94-7
Molecular Formula:
C9H11NOS
Molecular Weight:
181.2547
MDL Number:
MFCD14587794
IUPAC Name:
1-(2-cyclopropyl-4-methyl-1,3-thiazol-5-yl)ethanone
InChI:
InChI=1S/C9H11NOS/c1-5-8(6(2)11)12-9(10-5)7-3-4-7/h7H,3-4H2,1-2H3
InChI Key:
DHKVYOBELZNIAQ-UHFFFAOYSA-N
SMILES:
CC(=O)c1sc(nc1C)C1CC1

Properties

Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.056g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.253g/mol
Monoisotopic Mass:
181.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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