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(3,3-diethoxypropyl)dimethylamine

CAT: 0572-TRC-B593415-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B593415-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
16851-30-2
Hazard Statement
No Data Available
Smiles
CCOC(CCN(C)C)OCC
Molecular Formula
C9 H21 N O2
Molecular Weight
175.268
InChI
InChI=1S/C9H21NO2/c1-5-11-9(12-6-2)7-8-10(3)4/h9H,5-8H2,1-4H3
Additionnal Information
IUPAC name: 3,3-diethoxy-N,N-dimethylpropan-1-amine
Shipping Conditions
Room Temperature

Chemical Information

(3,3-Diethoxypropyl)dimethylamine
CAS Number16851-30-2
PubChem CID20540449
IUPAC Name3,3-diethoxy-N,N-dimethylpropan-1-amine
Molecular FormulaC9H21NO2
Molecular Weight175.27
XLogP1.2
Topological Polar Surface Area21.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count12
Formal Charge0
Complexity90
SMILES
CCOC(CCN(C)C)OCC
InChI
InChI=1S/C9H21NO2/c1-5-11-9(12-6-2)7-8-10(3)4/h9H,5-8H2,1-4H3
InChIKey
YNVCGLCZEGMEOS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (3,3-Diethoxypropyl)dimethylamine
CAS: 16851-30-2
CID: 20540449
Formula: C9H21NO2
MW: 175.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight175.27
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass175.157228913
Monoisotopic Mass175.157228913
Topological Polar Surface Area21.7 Ų
Heavy Atom Count12
Formal Charge0
Complexity90.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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