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52414-90-1 | 5-Butylthiazole
CAS No: 52414-90-1 Catalog No: AG00DS9J MDL No:
Product Description
Catalog Number:
AG00DS9J
Chemical Name:
5-Butylthiazole
CAS Number:
52414-90-1
IUPAC Name:
5-butyl-1,3-thiazole
InChI:
InChI=1S/C7H11NS/c1-2-3-4-7-5-8-6-9-7/h5-6H,2-4H2,1H3
InChI Key:
ZFNKEBZBVNSUCV-UHFFFAOYSA-N
Properties
Complexity:
75.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.061g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.232g/mol
Monoisotopic Mass:
141.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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