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1- (3-Methylmorpholin-4-yl) propan-2-amine

CAT: 0926-QYB92736-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-QYB92736-01Size:50 mg
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CAS Number
1215927-36-8
MDL Number
MFCD12134286
Smiles
CC1COCCN1CC (C) N
Molecular Formula
C8H18N2O
Molecular Weight
158.24 g/mol
Controlled
No

Chemical Information

1-(3-Methylmorpholin-4-yl)propan-2-amine
CAS Number1215927-36-8
PubChem CID43542022
IUPAC Name1-(3-methylmorpholin-4-yl)propan-2-amine
Molecular FormulaC8H18N2O
Molecular Weight158.24
XLogP-0.2
Topological Polar Surface Area38.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity119
SMILES
CC1COCCN1CC(C)N
InChI
InChI=1S/C8H18N2O/c1-7(9)5-10-3-4-11-6-8(10)2/h7-8H,3-6,9H2,1-2H3
InChIKey
WNGYSVZNVNLSJP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Methylmorpholin-4-yl)propan-2-amine
CAS: 1215927-36-8
CID: 43542022
Formula: C8H18N2O
MW: 158.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight158.24
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass158.141913202
Monoisotopic Mass158.141913202
Topological Polar Surface Area38.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity119
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes