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Home > Bromides > 1268334-99-1
1268334-99-1 | 1H-Pyrazole, 5-bromo-1-ethyl-
CAS No: 1268334-99-1 Catalog No: AG000TAZ MDL No:MFCD18447684
Product Description
Catalog Number:
AG000TAZ
Chemical Name:
1H-Pyrazole, 5-bromo-1-ethyl-
CAS Number:
1268334-99-1
Molecular Formula:
C5H7BrN2
Molecular Weight:
175.0265
MDL Number:
MFCD18447684
IUPAC Name:
5-bromo-1-ethylpyrazole
InChI:
InChI=1S/C5H7BrN2/c1-2-8-5(6)3-4-7-8/h3-4H,2H2,1H3
InChI Key:
GHCZXPXCEJYMOF-UHFFFAOYSA-N
SMILES:
CCn1nccc1Br
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.979g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.029g/mol
Monoisotopic Mass:
173.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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