N1-Boc-N1-methyl-1,4-butanediamine - CAS 144222-23-1
Catalog: |
BB009741 |
Product Name: |
N1-Boc-N1-methyl-1,4-butanediamine |
CAS: |
144222-23-1 |
Synonyms: |
N-(4-aminobutyl)-N-methylcarbamic acid tert-butyl ester; tert-butyl N-(4-aminobutyl)-N-methylcarbamate |
IUPAC Name: | tert-butyl N-(4-aminobutyl)-N-methylcarbamate |
Description: | N1-Boc-N1-methyl-1,4-butanediamine (CAS# 144222-23-1) is a useful research chemical. |
Molecular Weight: | 202.29 |
Molecular Formula: | C10H22N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N(C)CCCCN |
InChI: | InChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)12(4)8-6-5-7-11/h5-8,11H2,1-4H3 |
InChI Key: | CIZQQISFIQZTDF-UHFFFAOYSA-N |
Boiling Point: | 254.609 °C at 760 mmHg |
Density: | 0.983 g/cm3 |
LogP: | 2.29250 |
GHS Hazard Statement: | H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020138015-A1 | Pyrazolo[1,5-a]pyrimidine macrocyclic compound | 20181227 |
AU-2016225000-A1 | Inhibition of Olig2 activity | 20150227 |
EP-3261631-A1 | Inhibition of olig2 activity | 20150227 |
JP-2018510138-A | Inhibition of OLIG2 activity | 20150227 |
KR-20170129785-A | Inhibition of OLIG2 activity | 20150227 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.168127949 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.168127949 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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