Home Halogens 1-[(5-chlorothiophen-2-yl)methyl]-1H-pyrazol-5-amine

1-[(5-chlorothiophen-2-yl)methyl]-1H-pyrazol-5-amine

CAS No.:
1152588-32-3
Catalog Number:
AG01C99F
Molecular Formula:
C8H8ClN3S
Molecular Weight:
213.6872
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Product Description
Catalog Number:
AG01C99F
Chemical Name:
1-[(5-chlorothiophen-2-yl)methyl]-1H-pyrazol-5-amine
CAS Number:
1152588-32-3
Molecular Formula:
C8H8ClN3S
Molecular Weight:
213.6872
MDL Number:
MFCD11186331
IUPAC Name:
2-[(5-chlorothiophen-2-yl)methyl]pyrazol-3-amine
InChI:
InChI=1S/C8H8ClN3S/c9-7-2-1-6(13-7)5-12-8(10)3-4-11-12/h1-4H,5,10H2
InChI Key:
GRBIKNWFWQCAQV-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)Cn1nccc1N
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.683g/mol
Monoisotopic Mass:
213.013g/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