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1247358-96-8 | 1H-Pyrazole, 1-(2-chlorophenyl)-5-methyl-
CAS No: 1247358-96-8 Catalog No: AG000MOR MDL No:MFCD16042680
Product Description
Catalog Number:
AG000MOR
Chemical Name:
1H-Pyrazole, 1-(2-chlorophenyl)-5-methyl-
CAS Number:
1247358-96-8
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
MDL Number:
MFCD16042680
IUPAC Name:
1-(2-chlorophenyl)-5-methylpyrazole
InChI:
InChI=1S/C10H9ClN2/c1-8-6-7-12-13(8)10-5-3-2-4-9(10)11/h2-7H,1H3
InChI Key:
XUKNFSXHFVTOOA-UHFFFAOYSA-N
SMILES:
Clc1ccccc1n1nccc1C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.646g/mol
Monoisotopic Mass:
192.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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