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1015846-56-6 | 1H-Indazole-3-carbonitrile, 4-chloro-1-methyl-
CAS No: 1015846-56-6 Catalog No: AG0004WU MDL No:MFCD09971279
Product Description
Catalog Number:
AG0004WU
Chemical Name:
1H-Indazole-3-carbonitrile, 4-chloro-1-methyl-
CAS Number:
1015846-56-6
Molecular Formula:
C9H6ClN3
Molecular Weight:
191.6170
MDL Number:
MFCD09971279
IUPAC Name:
4-chloro-1-methylindazole-3-carbonitrile
InChI:
InChI=1S/C9H6ClN3/c1-13-8-4-2-3-6(10)9(8)7(5-11)12-13/h2-4H,1H3
InChI Key:
WDDAWSGEOSMNFS-UHFFFAOYSA-N
SMILES:
N#Cc1nn(c2c1c(Cl)ccc2)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.025g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.618g/mol
Monoisotopic Mass:
191.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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