Bis(3-chloropropyl)amine Hydrochloride - CAS 1081534-21-5
Catalog: |
BB073119 |
Product Name: |
Bis(3-chloropropyl)amine Hydrochloride |
CAS: |
1081534-21-5 |
Synonyms: |
Bis(3-chloropropyl)amine hydrochloride; 3-chloro-N-(3-chloropropyl)propan-1-amine; hydrochloride; Bis(3-chloropropyl)amine HCl |
IUPAC Name: | 3-chloro-N-(3-chloropropyl)propan-1-aminehydrochloride |
Description: | Bis(3-chloropropyl)amine Hydrochloride is used in silica studies, and is grafted onto a silica support to evaluate CO2 adsorption. |
Molecular Weight: | 206.54 |
Molecular Formula: | C6H13NCl2·HCl |
Canonical SMILES: | C(CNCCCCl)CCl.Cl |
InChI: | InChI=1S/C6H13Cl2N.ClH/c7-3-1-5-9-6-2-4-8/h9H,1-6H21H |
InChI Key: | MRDUJWJHJIMYDL-UHFFFAOYSA-N |
Melting Point: | >198°C (dec.) |
Solubility: | Chloroform (Slightly, Sonicated), Methanol (Slightly, Sonicated) |
Appearance: | Pale Brown to Light Brown Solid |
Storage: | -20°C, Hygroscopic |
References: | Yoo, C. et al. Ind. Eng. Chem. Res., 59, 7061 (2020). |
Complexity: | 44.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.019183 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.019183 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 12Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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