1-Isopropyl-1{H}-pyrazole-3-sulfonyl Chloride - CAS 1354704-87-2
Catalog: |
BB072691 |
Product Name: |
1-Isopropyl-1{H}-pyrazole-3-sulfonyl Chloride |
CAS: |
1354704-87-2 |
Synonyms: |
1-Isopropyl-1H-pyrazole-3-sulfonyl chloride; 1-propan-2-ylpyrazole-3-sulfonyl chloride; 1-Isopropyl-1H-pyrazole-3-sulfonylchloride; 1-(propan-2-yl)-1H-pyrazole-3-sulfonyl chloride |
IUPAC Name: | 1-propan-2-ylpyrazole-3-sulfonyl chloride |
Molecular Weight: | 208.67 |
Molecular Formula: | C6H9N2O2SCl |
Canonical SMILES: | CC(C)N1C=CC(=N1)S(=O)(=O)Cl |
InChI: | InChI=1S/C6H9ClN2O2S/c1-5(2)9-4-3-6(8-9)12(7,10)11/h3-5H,1-2H3 |
InChI Key: | UQKMYXQXNOLLRT-UHFFFAOYSA-N |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 |
Signal Word: | Danger |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.0073264 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.0073264 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS