4-Amino-1-(tert-butyl)pyrazole - CAS 97421-13-1
Catalog: |
BB042048 |
Product Name: |
4-Amino-1-(tert-butyl)pyrazole |
CAS: |
97421-13-1 |
Synonyms: |
1-tert-butyl-4-pyrazolamine; 1-tert-butylpyrazol-4-amine |
IUPAC Name: | 1-tert-butylpyrazol-4-amine |
Description: | 4-Amino-1-(tert-butyl)pyrazole (CAS# 97421-13-1) is a useful research chemical. |
Molecular Weight: | 139.20 |
Molecular Formula: | C7H13N3 |
Canonical SMILES: | CC(C)(C)N1C=C(C=N1)N |
InChI: | InChI=1S/C7H13N3/c1-7(2,3)10-5-6(8)4-9-10/h4-5H,8H2,1-3H3 |
InChI Key: | JPUFJDDEDJUDHE-UHFFFAOYSA-N |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
MDL: | MFCD11845713 |
LogP: | 1.80150 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021023888-A1 | Isoquinoline derivatives as protein kinase inhibitors | 20190808 |
WO-2020088390-A1 | Pyrimidopyrazole compounds as fourth generation egfr inhibitors | 20181029 |
CN-112771032-A | Pyrimidine pyrazole compounds as fourth generation EGFR inhibitors | 20181029 |
CN-110734427-A | Alkenyl-containing pyrimidine formamide compound, composition and application thereof | 20180720 |
CN-110734427-B | Alkenyl-containing pyrimidine formamide compound, composition and application thereof | 20180720 |
Complexity: | 117 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.110947427 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.110947427 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Amines and Anilines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS