Home Other Building Blocks (1,5-dimethyl-1H-pyrazol-3-yl)(5-methylthiophen-3-yl)methanol

(1,5-dimethyl-1H-pyrazol-3-yl)(5-methylthiophen-3-yl)methanol

CAS No.:
1694999-81-9
Catalog Number:
AG01C4GC
Molecular Formula:
C11H14N2OS
Molecular Weight:
222.3067
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Product Description
Catalog Number:
AG01C4GC
Chemical Name:
(1,5-dimethyl-1H-pyrazol-3-yl)(5-methylthiophen-3-yl)methanol
CAS Number:
1694999-81-9
Molecular Formula:
C11H14N2OS
Molecular Weight:
222.3067
MDL Number:
MFCD29763114
IUPAC Name:
(1,5-dimethylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanol
InChI:
InChI=1S/C11H14N2OS/c1-7-4-10(12-13(7)3)11(14)9-5-8(2)15-6-9/h4-6,11,14H,1-3H3
InChI Key:
MIQJVAIMTZULLS-UHFFFAOYSA-N
SMILES:
Cc1scc(c1)C(c1cc(n(n1)C)C)O
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.083g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.306g/mol
Monoisotopic Mass:
222.083g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties