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3-Fluorophenmetrazine Hydrochloride

CAT: 0572-TRC-F489590-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F489590-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1803562-83-5
Hazard Statement
No Data Available
Smiles
Cl.CC1NCCOC1c2cccc(F)c2
Molecular Formula
C11 H14 F N O . Cl H
Molecular Weight
231.69
InChI
InChI=1S/C11H14FNO.ClH/c1-8-11(14-6-5-13-8)9-3-2-4-10(12)7-9;/h2-4,7-8,11,13H,5-6H2,1H3;1H
Additionnal Information
IUPAC name: 2-(3-fluorophenyl)-3-methylmorpholine;hydrochloride
Shipping Conditions
Room Temperature

Chemical Information

3-Fluorophenmetrazipine HCl
CAS Number1803562-83-5
PubChem CID75481405
IUPAC Name2-(3-fluorophenyl)-3-methylmorpholine;hydrochloride
Molecular FormulaC11H15ClFNO
Molecular Weight231.69
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity188
SMILES
CC1C(OCCN1)C2=CC(=CC=C2)F.Cl
InChI
InChI=1S/C11H14FNO.ClH/c1-8-11(14-6-5-13-8)9-3-2-4-10(12)7-9;/h2-4,7-8,11,13H,5-6H2,1H3;1H
InChIKey
MHJBXKFJWSBWRE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Fluorophenmetrazipine HCl
CAS: 1803562-83-5
CID: 75481405
Formula: C11H15ClFNO
MW: 231.69
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight231.69
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass231.0826200
Monoisotopic Mass231.0826200
Topological Polar Surface Area21.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity188
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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