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About This Item
Linear Formula:
HOC6H3(OCH3)CH(CH2NHCH3)OH·HCl
CAS Number:
Molecular Weight:
233.69
UNSPSC Code:
12352100
PubChem Substance ID:
EC Number:
212-922-2
MDL number:
InChI key
HRIQFVCFOPJYEQ-UHFFFAOYSA-N
InChI
1S/C10H15NO3.ClH/c1-11-6-9(13)7-3-4-8(12)10(5-7)14-2;/h3-5,9,11-13H,6H2,1-2H3;1H
SMILES string
Cl.CNCC(O)c1ccc(O)c(OC)c1
assay
99%
mp
175 °C (dec.) (lit.)
signalword
Warning
hcodes
pcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Augusto Q Pedro et al.
Microbial cell factories, 14, 113-113 (2015-08-08)
Membrane proteins are important drug targets in many human diseases and gathering structural information regarding these proteins encourages the pharmaceutical industry to develop new molecules using structure-based drug design studies. Specifically, membrane-bound catechol-O-methyltransferase (MBCOMT) is an integral membrane protein that
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