78842-74-7
Product Name:
METHYL 3-(4-BROMOPHENYL)-1H-PYRAZOLE-5-CARBOXYLATE
Formula:
C11H9BrN2O2
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COMPUTED DESCRIPTORS
Molecular Weight | 281.10 g/mol |
---|---|
XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 279.98474 g/mol |
Monoisotopic Mass | 279.98474 g/mol |
Topological Polar Surface Area | 55 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 254 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid methyl ester is a ring assembly and a member of pyrazoles.