1,3-Bis(allylamino)-2-propanol Dihydrochloride - CAS 1101184-94-4
Catalog: |
BB061392 |
Product Name: |
1,3-Bis(allylamino)-2-propanol Dihydrochloride |
CAS: |
1101184-94-4 |
Synonyms: |
1,3-Bis(allylamino)-2-propanolDihydrochloride; 1,3-bis(prop-2-enylamino)propan-2-ol; hydrochloride |
IUPAC Name: | 1,3-bis(prop-2-enylamino)propan-2-olhydrochloride |
Molecular Weight: | 170.25 + 2(36.46) |
Molecular Formula: | C9H18N2O·2(HCl) |
Canonical SMILES: | C=CCNCC(CNCC=C)O.Cl |
InChI: | InChI=1S/C9H18N2O.ClH/c1-3-5-10-7-9(12)8-11-6-4-2/h3-4,9-12H,1-2,5-8H21H |
InChI Key: | ZZMXMCZSICGATP-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 112 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.1185909 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.1185909 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 44.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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