N,N'-Di-2-propenyl-1,3-propanediamine dihydrochloride - CAS 205041-15-2
Catalog: |
BB054492 |
Product Name: |
N,N'-Di-2-propenyl-1,3-propanediamine dihydrochloride |
CAS: |
205041-15-2 |
Synonyms: |
N1,N3-Diallylpropane-1,3-diamine dihydrochloride; 1,3-Propanediamine, N1,N3-di-2-propen-1-yl-, hydrochloride (1:2) |
IUPAC Name: | N,N'-bis(prop-2-enyl)propane-1,3-diamine;dihydrochloride |
Molecular Weight: | 227.17 |
Molecular Formula: | C9H20Cl2N2 |
Canonical SMILES: | C=CCNCCCNCC=C.Cl.Cl |
InChI: | InChI=1S/C9H18N2.2ClH/c1-3-6-10-8-5-9-11-7-4-2;;/h3-4,10-11H,1-2,5-9H2;2*1H |
InChI Key: | FIOHNBDWNRXDFA-UHFFFAOYSA-N |
Purity: | 98% |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 87.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.100354 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.100354 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 24.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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