tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate - CAS 1823277-40-2
Catalog: |
BB013910 |
Product Name: |
tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate |
CAS: |
1823277-40-2 |
Synonyms: |
N-[6-(aminomethyl)-3-pyridazinyl]carbamic acid tert-butyl ester; tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate |
IUPAC Name: | tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate |
Description: | tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate (CAS# 1823277-40-2 ) is a useful research chemical. |
Molecular Weight: | 224.264 |
Molecular Formula: | C10H16N4O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=NN=C(C=C1)CN |
InChI: | InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)12-8-5-4-7(6-11)13-14-8/h4-5H,6,11H2,1-3H3,(H,12,14,15) |
InChI Key: | HBMNKSMCCWNPOP-UHFFFAOYSA-N |
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, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.12732577 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.12732577 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 90.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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