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933740-86-4 | 2-Butanone, 4-(2-thiazolyl)-
CAS No: 933740-86-4 Catalog No: AG00H5H4 MDL No:MFCD18813405
Product Description
Catalog Number:
AG00H5H4
Chemical Name:
2-Butanone, 4-(2-thiazolyl)-
CAS Number:
933740-86-4
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
MDL Number:
MFCD18813405
IUPAC Name:
4-(1,3-thiazol-2-yl)butan-2-one
InChI:
InChI=1S/C7H9NOS/c1-6(9)2-3-7-8-4-5-10-7/h4-5H,2-3H2,1H3
InChI Key:
LLEUSJWJPIGVOJ-UHFFFAOYSA-N
SMILES:
CC(=O)CCc1nccs1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.215g/mol
Monoisotopic Mass:
155.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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