4-(2-aminoethyl)benzene-1,3-diol hydrochloride - CAS 1432-22-0
Catalog: |
BB075100 |
Product Name: |
4-(2-aminoethyl)benzene-1,3-diol hydrochloride |
CAS: |
1432-22-0 |
Synonyms: |
4-(2-aminoethyl)benzene-1,3-diol hydrochloride; 4-(2-aminoethyl)benzene-1,3-diol; hydrochloride; 4-(2-aminoethyl)benzene-1,3-diolhydrochloride |
IUPAC Name: | 4-(2-aminoethyl)benzene-1,3-diolhydrochloride |
Molecular Weight: | 189.63 |
Molecular Formula: | C8H11NO2·HCl |
Canonical SMILES: | C1=CC(=C(C=C1O)O)CCN.Cl |
InChI: | InChI=1S/C8H11NO2.ClH/c9-4-3-6-1-2-7(10)5-8(6)11/h1-2,5,10-11H,3-4,9H21H |
InChI Key: | GBHIWVGWSZHYFR-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.0556563 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.0556563 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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