Home Halogens 1-(2-bromoethyl)-1H-pyrazole hydrobromide

1-(2-bromoethyl)-1H-pyrazole hydrobromide

CAS No.:
1955531-53-9
Catalog Number:
AG01C1SW
Molecular Formula:
C5H8Br2N2
Molecular Weight:
255.9384
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Product Description
Catalog Number:
AG01C1SW
Chemical Name:
1-(2-bromoethyl)-1H-pyrazole hydrobromide
CAS Number:
1955531-53-9
Molecular Formula:
C5H8Br2N2
Molecular Weight:
255.9384
MDL Number:
MFCD29054889
IUPAC Name:
1-(2-bromoethyl)pyrazole;hydrobromide
InChI:
InChI=1S/C5H7BrN2.BrH/c6-2-5-8-4-1-3-7-8;/h1,3-4H,2,5H2;1H
InChI Key:
OCDXQTCMYCZKKW-UHFFFAOYSA-N
SMILES:
BrCCn1cccn1.Br
Properties
Complexity:
67.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.903g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.941g/mol
Monoisotopic Mass:
253.905g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties