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1087792-30-0

1087792-30-0 | 1-(2-tert-butyl-4-methyl-1,3-thiazol-5-yl)ethan-1-one

CAS No: 1087792-30-0 Catalog No: AG019MUP MDL No:MFCD11099538

Product Description

Catalog Number:
AG019MUP
Chemical Name:
1-(2-tert-butyl-4-methyl-1,3-thiazol-5-yl)ethan-1-one
CAS Number:
1087792-30-0
Molecular Formula:
C10H15NOS
Molecular Weight:
197.2972
MDL Number:
MFCD11099538
IUPAC Name:
1-(2-tert-butyl-4-methyl-1,3-thiazol-5-yl)ethanone
InChI:
InChI=1S/C10H15NOS/c1-6-8(7(2)12)13-9(11-6)10(3,4)5/h1-5H3
InChI Key:
RODSPZYICFCYLS-UHFFFAOYSA-N
SMILES:
CC(=O)c1sc(nc1C)C(C)(C)C

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.087g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.296g/mol
Monoisotopic Mass:
197.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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