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143426-52-2 | 1-(4-(Chloromethyl)phenyl)-1H-pyrazole
CAS No: 143426-52-2 Catalog No: AG003DTG MDL No:MFCD07366379
Product Description
Catalog Number:
AG003DTG
Chemical Name:
1-(4-(Chloromethyl)phenyl)-1H-pyrazole
CAS Number:
143426-52-2
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
MDL Number:
MFCD07366379
IUPAC Name:
1-[4-(chloromethyl)phenyl]pyrazole
InChI:
InChI=1S/C10H9ClN2/c11-8-9-2-4-10(5-3-9)13-7-1-6-12-13/h1-7H,8H2
InChI Key:
PAINSRDHMRYAGK-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)n1cccn1
Properties
Complexity:
155
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:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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