Home Other Building Blocks 2-ethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol

2-ethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol

CAS No.:
1250434-52-6
Catalog Number:
AG019ZW3
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
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Product Description
Catalog Number:
AG019ZW3
Chemical Name:
2-ethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
CAS Number:
1250434-52-6
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
MDL Number:
MFCD16671196
IUPAC Name:
2-ethyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
InChI:
InChI=1S/C9H13NOS/c1-2-8-10-6-4-3-5-7(11)9(6)12-8/h7,11H,2-5H2,1H3
InChI Key:
LNKIPKMIUUOOLW-UHFFFAOYSA-N
SMILES:
CCc1nc2c(s1)C(O)CCC2
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.269g/mol
Monoisotopic Mass:
183.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties