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166313-49-1 | Ethyl 4-(Bromomethyl)-1,3-dimethyl-1H-pyrazole-5-carboxylate
CAS No: 166313-49-1 Catalog No: AG01FLP8 MDL No:
Product Description
Catalog Number:
AG01FLP8
Chemical Name:
Ethyl 4-(Bromomethyl)-1,3-dimethyl-1H-pyrazole-5-carboxylate
CAS Number:
166313-49-1
IUPAC Name:
ethyl 4-(bromomethyl)-2,5-dimethylpyrazole-3-carboxylate
InChI:
InChI=1S/C9H13BrN2O2/c1-4-14-9(13)8-7(5-10)6(2)11-12(8)3/h4-5H2,1-3H3
InChI Key:
DYOBCGBVXCODKN-UHFFFAOYSA-N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.016g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.119g/mol
Monoisotopic Mass:
260.016g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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