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Home > Bromides > 1011801-59-4
1011801-59-4 | 1H-Pyrazole, 1-(2-bromoethyl)-4-chloro-
CAS No: 1011801-59-4 Catalog No: AG0003W0 MDL No:MFCD03727250
Product Description
Catalog Number:
AG0003W0
Chemical Name:
1H-Pyrazole, 1-(2-bromoethyl)-4-chloro-
CAS Number:
1011801-59-4
Molecular Formula:
C5H6BrClN2
Molecular Weight:
209.4715
MDL Number:
MFCD03727250
IUPAC Name:
1-(2-bromoethyl)-4-chloropyrazole
InChI:
InChI=1S/C5H6BrClN2/c6-1-2-9-4-5(7)3-8-9/h3-4H,1-2H2
InChI Key:
JWVGNGVIZSRTHN-UHFFFAOYSA-N
SMILES:
Clc1cn(nc1)CCBr
Properties
Complexity:
91
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.94g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.471g/mol
Monoisotopic Mass:
207.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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