1-Boc-3-methyleneazetidine - CAS 934664-41-2
Catalog: |
BB040935 |
Product Name: |
1-Boc-3-methyleneazetidine |
CAS: |
934664-41-2 |
Synonyms: |
3-methylene-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-methylideneazetidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-methylideneazetidine-1-carboxylate |
Description: | 1-Boc-3-methyleneazetidine (CAS# 934664-41-2) is a useful reagent used in the preparation of functionalized difluorocyclopropanes as building blocks for drug discoveries. |
Molecular Weight: | 169.22 |
Molecular Formula: | C9H15NO2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(=C)C1 |
InChI: | InChI=1S/C9H15NO2/c1-7-5-10(6-7)8(11)12-9(2,3)4/h1,5-6H2,2-4H3 |
InChI Key: | MECAHFSQQZQZOI-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 ℃ |
MDL: | MFCD12031229 |
LogP: | 1.73120 |
GHS Hazard Statement: | H302+H312+H332 (98.73%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021119176-A | Cyclic peptide compound with Kras inhibitory effect | 20191107 |
JP-6880352-B1 | Cyclic peptide compound with Kras inhibitory effect | 20191107 |
KR-20210064234-A | Cyclic peptide compound having Kras inhibitory action | 20191107 |
WO-2021090855-A1 | Cyclic peptide compound having kras inhibiting action | 20191107 |
US-2021128744-A1 | Thienoazepine immunoconjugates, and uses thereof | 20191025 |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.110278721 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Azetidines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS