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1020706-50-6 | 2-(3-(thiophen-2-yl)-1H-pyrazol-1-yl)ethan-1-amine
CAS No: 1020706-50-6 Catalog No: AG01FLV9 MDL No:MFCD06804815
Product Description
Catalog Number:
AG01FLV9
Chemical Name:
2-(3-(thiophen-2-yl)-1H-pyrazol-1-yl)ethan-1-amine
CAS Number:
1020706-50-6
Molecular Formula:
C9H11N3S
Molecular Weight:
193.2687
MDL Number:
MFCD06804815
IUPAC Name:
2-(3-thiophen-2-ylpyrazol-1-yl)ethanamine
InChI:
InChI=1S/C9H11N3S/c10-4-6-12-5-3-8(11-12)9-2-1-7-13-9/h1-3,5,7H,4,6,10H2
InChI Key:
FGLAUZMWRWBBGS-UHFFFAOYSA-N
SMILES:
NCCn1ccc(n1)c1cccs1
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.268g/mol
Monoisotopic Mass:
193.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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