Benzenesulfonyl chloride, 4-(1H-pyrazol-1-yl)-


Chemical Name: Benzenesulfonyl chloride, 4-(1H-pyrazol-1-yl)-
CAS Number: 18336-39-5
Product Number: AG0027IV(AGN-PC-0KKXK5)
Synonyms:
MDL No:
Molecular Formula: C9H7ClN2O2S
Molecular Weight: 242.6821

Identification/Properties


Computed Properties
Molecular Weight:
242.677g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
241.992g/mol
Monoisotopic Mass:
241.992g/mol
Topological Polar Surface Area:
60.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
307
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P301+P330+P331-P310-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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