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Clorprenaline

CAT: 1299-RM-C281000-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-C281000-02Size:25 mg
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CAS Number
3811-25-4
Synonyms
1- (2-chlorophenyl) -2- (isopropylamino) ethan-1-ol
Molecular Formula
C11H16ClNO
Molecular Weight
213.71
Target Alternative Name
Clorprenaline
Product Name Synonym
1- (2-chlorophenyl) -2- (isopropylamino) ethan-1-ol

Chemical Information

Clorprenaline

1-(2-chlorophenyl)-2-isopropylaminoethanol is a member of the class of monochlorobenzenes that is chlorobenzene which is substituted by a 1-hydroxy-2-[(propan-2-yl)amino]ethyl group at position 2. It is a member of ethanolamines, a secondary amino compound and a member of monochlorobenzenes.

CAS Number3811-25-4
PubChem CID2810
IUPAC Name1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol
Molecular FormulaC11H16ClNO
Molecular Weight213.70
XLogP2.1
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity163
SMILES
CC(C)NCC(C1=CC=CC=C1Cl)O
InChI
InChI=1S/C11H16ClNO/c1-8(2)13-7-11(14)9-5-3-4-6-10(9)12/h3-6,8,11,13-14H,7H2,1-2H3
InChIKey
SSMSBSWKLKKXGG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Clorprenaline
CAS: 3811-25-4
CID: 2810
Formula: C11H16ClNO
MW: 213.70
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight213.70
XLogP32.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass213.0920418
Monoisotopic Mass213.0920418
Topological Polar Surface Area32.3 Ų
Heavy Atom Count14
Formal Charge0
Complexity163
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

Alternative Products

CatalogName
AG165Clorprenaline
575093Clorprenaline hydrochloride
MBS577783Clorprenaline HCl
DAG129OClorprenaline [OVA]
HY-134577RClorprenaline (Standard)
TMIH-0165-01Clorprenaline-d7
HY-134577S-01Clorprenaline-d6

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