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2-chloromethyl-morpholine hcl

CAT: 0926-UFA05397Size: 2.5 gDry Ice: NoHazardous: No
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CAT#:0926-UFA05397Size:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
144053-97-4
MDL Number
MFCD18711391
Smiles
C1COC (CN1) CCl.Cl
Molecular Formula
C5H11Cl2NO
Molecular Weight
172.05 g/mol
Controlled
No

Chemical Information

2-(Chloromethyl)morpholine hydrochloride
CAS Number144053-97-4
PubChem CID19777253
IUPAC Name2-(chloromethyl)morpholine;hydrochloride
Molecular FormulaC5H11Cl2NO
Molecular Weight172.05
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity69
SMILES
C1COC(CN1)CCl.Cl
InChI
InChI=1S/C5H10ClNO.ClH/c6-3-5-4-7-1-2-8-5;/h5,7H,1-4H2;1H
InChIKey
DJGDVVWHFIEBJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Chloromethyl)morpholine hydrochloride
CAS: 144053-97-4
CID: 19777253
Formula: C5H11Cl2NO
MW: 172.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight172.05
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass171.0217694
Monoisotopic Mass171.0217694
Topological Polar Surface Area21.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity69.4
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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