4-(Boc-amino)butyl bromide - CAS 164365-88-2
Catalog: |
BB012103 |
Product Name: |
4-(Boc-amino)butyl bromide |
CAS: |
164365-88-2 |
Synonyms: |
tert-butyl N-(4-bromobutyl)carbamate |
IUPAC Name: | tert-butyl N-(4-bromobutyl)carbamate |
Description: | 4-(Boc-amino)butyl bromide (CAS# 164365-88-2) is a compound useful in organic synthesis. |
Molecular Weight: | 252.15 |
Molecular Formula: | C9H18BrNO2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCCCCBr |
InChI: | InChI=1S/C9H18BrNO2/c1-9(2,3)13-8(12)11-7-5-4-6-10/h4-7H2,1-3H3,(H,11,12) |
InChI Key: | GKGFAEREWWZBKY-UHFFFAOYSA-N |
Boiling Point: | 308.8 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.244 g/cm3 |
Storage: | 2-8 ℃ |
MDL: | MFCD06201020 |
LogP: | 3.07710 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P280, P305+P351+P338, and P310 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
KR-20210122708-A | HMG-CoA Reductase Degradation Inducing Compound | 20200330 |
WO-2021201577-A1 | Hmg-coa reductase degradation inducing compound | 20200330 |
WO-2021195295-A1 | Bifunctional molecules and methods of using thereof | 20200324 |
JP-2021138671-A | PPM1D inhibitor | 20200309 |
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Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 251.05209 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 251.05209 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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