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Morpholin-2-yl-acetic acid

CAT: 0127-OR92391-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR92391-01Size:250 mg
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CAS Number
180863-27-8
MDL Number
MFCD04038685
Purity
97%
Smiles
OC(=O)CC1CNCCO1

Chemical Information

2-Morpholineacetic acid
CAS Number180863-27-8
PubChem CID5046244
IUPAC Name2-morpholin-2-ylacetic acid
Molecular FormulaC6H11NO3
Molecular Weight145.16
XLogP-3.3
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity126
SMILES
C1COC(CN1)CC(=O)O
InChI
InChI=1S/C6H11NO3/c8-6(9)3-5-4-7-1-2-10-5/h5,7H,1-4H2,(H,8,9)
InChIKey
TWCXRVFSIAWFMA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Morpholineacetic acid
CAS: 180863-27-8
CID: 5046244
Formula: C6H11NO3
MW: 145.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight145.16
XLogP3-3.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass145.07389321
Monoisotopic Mass145.07389321
Topological Polar Surface Area58.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity126
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