Home Halogens 3-(4-bromo-1H-pyrazol-1-yl)-N,N-dimethylpropanamide

3-(4-bromo-1H-pyrazol-1-yl)-N,N-dimethylpropanamide

CAS No.:
1184274-21-2
Catalog Number:
AG01AAD6
Molecular Formula:
C8H12BrN3O
Molecular Weight:
246.1044
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Product Description
Catalog Number:
AG01AAD6
Chemical Name:
3-(4-bromo-1H-pyrazol-1-yl)-N,N-dimethylpropanamide
CAS Number:
1184274-21-2
Molecular Formula:
C8H12BrN3O
Molecular Weight:
246.1044
MDL Number:
MFCD12824378
IUPAC Name:
3-(4-bromopyrazol-1-yl)-N,N-dimethylpropanamide
InChI:
InChI=1S/C8H12BrN3O/c1-11(2)8(13)3-4-12-6-7(9)5-10-12/h5-6H,3-4H2,1-2H3
InChI Key:
FTQFHOQJKZCTJK-UHFFFAOYSA-N
SMILES:
CN(C(=O)CCn1ncc(c1)Br)C
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.016g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.108g/mol
Monoisotopic Mass:
245.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties