3-Hydroxytyramine hydrobromide - CAS 645-31-8
Catalog: |
BB032493 |
Product Name: |
3-Hydroxytyramine hydrobromide |
CAS: |
645-31-8 |
Synonyms: |
4-(2-aminoethyl)benzene-1,2-diol;hydrobromide |
IUPAC Name: | 4-(2-aminoethyl)benzene-1,2-diol;hydrobromide |
Description: | 3-Hydroxytyramine hydrobromide (CAS# 645-31-8) is a useful research chemical. |
Molecular Weight: | 234.09 |
Molecular Formula: | C8H12BrNO2 |
Canonical SMILES: | C1=CC(=C(C=C1CCN)O)O.Br |
InChI: | InChI=1S/C8H11NO2.BrH/c9-4-3-6-1-2-7(10)8(11)5-6;/h1-2,5,10-11H,3-4,9H2;1H |
InChI Key: | SGRSNYSOAPBTJP-UHFFFAOYSA-N |
Boiling Point: | 337.7 °C at 760 mmHg |
Appearance: | White to off-off white solid |
MDL: | MFCD00012897 |
LogP: | 2.25740 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.00514 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.00514 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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