1,4-Dimethyl-1H-pyrazole-5-sulfonyl chloride - CAS 1174834-52-6
Catalog: |
BB003946 |
Product Name: |
1,4-Dimethyl-1H-pyrazole-5-sulfonyl chloride |
CAS: |
1174834-52-6 |
Synonyms: |
2,4-dimethylpyrazole-3-sulfonyl chloride |
IUPAC Name: | 2,4-dimethylpyrazole-3-sulfonyl chloride |
Description: | 1,4-Dimethyl-1H-pyrazole-5-sulfonyl chloride (CAS# 1174834-52-6) is a useful research chemical. |
Molecular Weight: | 194.64 |
Molecular Formula: | C5H7ClN2O2S |
Canonical SMILES: | CC1=C(N(N=C1)C)S(=O)(=O)Cl |
InChI: | InChI=1S/C5H7ClN2O2S/c1-4-3-7-8(2)5(4)11(6,9)10/h3H,1-2H3 |
InChI Key: | SAVUTYCQFZZSEI-UHFFFAOYSA-N |
LogP: | 1.73680 |
GHS Hazard Statement: | H315 (97.44%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
DK-2855449-T3 | Sulphonylpiperide ingredients and its use for treatment of prokineticin medied diseases | 20120530 |
EP-2855449-A1 | Sulfonyl piperidine derivatives and their use for treating prokineticin mediated diseases | 20120530 |
EP-2855449-B1 | Sulfonyl piperidine derivatives and their use for treating prokineticin mediated diseases | 20120530 |
ES-2671629-T3 | Sulfonyl-piperidine derivatives and their use to treat procineticin-mediated diseases | 20120530 |
JP-2015519357-A | Therapeutic compounds | 20120530 |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.9916763 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.9916763 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 60.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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Related Functional Groups
Pyrazoles
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