N-Boc-3-(methylamino)-1-propanol - CAS 98642-44-5
Catalog: |
BB042204 |
Product Name: |
N-Boc-3-(methylamino)-1-propanol |
CAS: |
98642-44-5 |
Synonyms: |
N-(3-hydroxypropyl)-N-methylcarbamic acid tert-butyl ester; tert-butyl N-(3-hydroxypropyl)-N-methylcarbamate |
IUPAC Name: | tert-butyl N-(3-hydroxypropyl)-N-methylcarbamate |
Description: | N-Boc-3-(methylamino)-1-propanol (CAS# 98642-44-5) is a compound useful in organic synthesis. |
Molecular Weight: | 189.25 |
Molecular Formula: | C9H19NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N(C)CCCO |
InChI: | InChI=1S/C9H19NO3/c1-9(2,3)13-8(12)10(4)6-5-7-11/h11H,5-7H2,1-4H3 |
InChI Key: | GJGLBUZZTLPCOT-UHFFFAOYSA-N |
Appearance: | Light yellow oil |
LogP: | 1.23570 |
Publication Number | Title | Priority Date |
WO-2021204896-A1 | Macrocyclic diamine derivatives as ent inhibitors for the treatment of cancers, and combination thereof with adenosine receptor antagonists | 20200407 |
US-2021315896-A1 | Indazole based compounds and associated methods of use | 20200321 |
WO-2021194879-A1 | Indazole based compounds and associated methods of use | 20200321 |
WO-2021188948-A1 | Mdm2 degraders and uses thereof | 20200319 |
WO-2021178339-A1 | Heterobifunctional molecules as tead inhibitors | 20200304 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.13649347 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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