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65202-52-0 | Methyl 6-bromopyridazine-3-carboxylate
CAS No: 65202-52-0 Catalog No: AG0039NT MDL No:MFCD14584508
Product Description
Catalog Number:
AG0039NT
Chemical Name:
Methyl 6-bromopyridazine-3-carboxylate
CAS Number:
65202-52-0
Molecular Formula:
C6H5BrN2O2
Molecular Weight:
217.0201
MDL Number:
MFCD14584508
IUPAC Name:
methyl 6-bromopyridazine-3-carboxylate
InChI:
InChI=1S/C6H5BrN2O2/c1-11-6(10)4-2-3-5(7)9-8-4/h2-3H,1H3
InChI Key:
LKZGTZCGPJWPSU-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nn1)Br
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.953g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.022g/mol
Monoisotopic Mass:
215.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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