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885278-48-8 | Methyl 5,6-dichloro-1H-indazole-3-carboxylate
CAS No: 885278-48-8 Catalog No: AG0045V6 MDL No:MFCD07371585
Product Description
Catalog Number:
AG0045V6
Chemical Name:
Methyl 5,6-dichloro-1H-indazole-3-carboxylate
CAS Number:
885278-48-8
Molecular Formula:
C9H6Cl2N2O2
Molecular Weight:
245.0621
MDL Number:
MFCD07371585
IUPAC Name:
methyl 5,6-dichloro-1H-indazole-3-carboxylate
InChI:
InChI=1S/C9H6Cl2N2O2/c1-15-9(14)8-4-2-5(10)6(11)3-7(4)12-13-8/h2-3H,1H3,(H,12,13)
InChI Key:
UGGKDWFFFAWYKS-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]c2c1cc(Cl)c(c2)Cl
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.981g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.059g/mol
Monoisotopic Mass:
243.981g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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