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Noradrenaline (Norepinephrine) Impurity 26

CAT: 1299-RM-N151826-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N151826-01Size:10 mg
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CAS Number
373360-12-4
Synonyms
4- (2-amino-1-hydroxyethyl) benzene-1,3-diol
Molecular Formula
C8H11NO3
Molecular Weight
169.18
Target Alternative Name
Noradrenaline
Product Name Synonym
4- (2-amino-1-hydroxyethyl) benzene-1,3-diol

Chemical Information

4-(2-Amino-1-hydroxyethyl)benzene-1,3-diol
CAS Number373360-12-4
PubChem CID16768311
IUPAC Name4-(2-amino-1-hydroxyethyl)benzene-1,3-diol
Molecular FormulaC8H11NO3
Molecular Weight169.18
XLogP0
Topological Polar Surface Area86.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity142
SMILES
C1=CC(=C(C=C1O)O)C(CN)O
InChI
InChI=1S/C8H11NO3/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,8,10-12H,4,9H2
InChIKey
MIYPYKIYQZUXLP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2-Amino-1-hydroxyethyl)benzene-1,3-diol
CAS: 373360-12-4
CID: 16768311
Formula: C8H11NO3
MW: 169.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight169.18
XLogP30
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass169.07389321
Monoisotopic Mass169.07389321
Topological Polar Surface Area86.7 Ų
Heavy Atom Count12
Formal Charge0
Complexity142
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes