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3-Nonadecanone

CAT: 1596-AR-P30671-06Size: 250 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P30671-06Size:250 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
27372-42-5
Molecular Formula
C19H38O
Molecular Weight
282.51
API Name
Pentacosane

Chemical Information

3-Nonadecanone
CAS Number27372-42-5
PubChem CID296879
IUPAC Namenonadecan-3-one
Molecular FormulaC19H38O
Molecular Weight282.5
XLogP8.4
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count16
Heavy Atom Count20
Formal Charge0
Complexity198
SMILES
CCCCCCCCCCCCCCCCC(=O)CC
InChI
InChI=1S/C19H38O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)4-2/h3-18H2,1-2H3
InChIKey
AMCPCQBTXANXJZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Nonadecanone
CAS: 27372-42-5
CID: 296879
Formula: C19H38O
MW: 282.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight282.5
XLogP38.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count16
Exact Mass282.292265831
Monoisotopic Mass282.292265831
Topological Polar Surface Area17.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity198
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