Home Other Building Blocks 1-tert-butyl-3-(thiophen-2-yl)-1H-pyrazol-5-amine

1-tert-butyl-3-(thiophen-2-yl)-1H-pyrazol-5-amine

CAS No.:
1154329-62-0
Catalog Number:
AG01BFQA
Molecular Formula:
C11H15N3S
Molecular Weight:
221.3219
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Product Description
Catalog Number:
AG01BFQA
Chemical Name:
1-tert-butyl-3-(thiophen-2-yl)-1H-pyrazol-5-amine
CAS Number:
1154329-62-0
Molecular Formula:
C11H15N3S
Molecular Weight:
221.3219
MDL Number:
MFCD12168891
IUPAC Name:
2-tert-butyl-5-thiophen-2-ylpyrazol-3-amine
InChI:
InChI=1S/C11H15N3S/c1-11(2,3)14-10(12)7-8(13-14)9-5-4-6-15-9/h4-7H,12H2,1-3H3
InChI Key:
CXFCKNUJVHHMSB-UHFFFAOYSA-N
SMILES:
Nc1cc(nn1C(C)(C)C)c1cccs1
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.099g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.322g/mol
Monoisotopic Mass:
221.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties