N-Boc-2-methyl-1,3-propanediamine - CAS 480452-05-9
Catalog: |
BB026484 |
Product Name: |
N-Boc-2-methyl-1,3-propanediamine |
CAS: |
480452-05-9 |
Synonyms: |
N-(3-amino-2-methylpropyl)carbamic acid tert-butyl ester; tert-butyl N-(3-amino-2-methylpropyl)carbamate |
IUPAC Name: | tert-butyl N-(3-amino-2-methylpropyl)carbamate |
Description: | N-Boc-2-methyl-1,3-propanediamine (CAS# 480452-05-9) is a useful research chemical. |
Molecular Weight: | 188.27 |
Molecular Formula: | C9H20N2O2 |
Canonical SMILES: | CC(CN)CNC(=O)OC(C)(C)C |
InChI: | InChI=1S/C9H20N2O2/c1-7(5-10)6-11-8(12)13-9(2,3)4/h7H,5-6,10H2,1-4H3,(H,11,12) |
InChI Key: | ORDMEFMUSKDHOL-UHFFFAOYSA-N |
Boiling Point: | 282.585 °C at 760 mmHg |
Density: | 0.98 g/cm3 |
Appearance: | Colorless clear liquid |
LogP: | 2.19710 |
GHS Hazard Statement: | H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020231584-A1 | PCSK9 Inhibitors and Methods of Use Thereof | 20190118 |
US-2020291041-A1 | PCSK9 Inhibitors and Methods of Use Thereof | 20190118 |
WO-2020150473-A2 | Pcsk9 inhibitors and methods of use thereof | 20190118 |
WO-2020150474-A1 | Pcsk9 inhibitors and methods of use thereof | 20190118 |
KR-20210116548-A | PCSK9 inhibitors and methods of use thereof | 20190118 |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.152477885 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 64.4 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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Amines and Anilines
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