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Hexacosanoyl Chloride

CAT: 0572-TRC-H145410-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-H145410-5GSize:5 g
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CAS Number
145411-41-2
Hazard Statement
No Data Available
Smiles
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)Cl
Molecular Formula
C26 H51 Cl O
Molecular Weight
415.135
InChI
InChI=1S/C26H51ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h2-25H2,1H3
Additionnal Information
IUPAC name: hexacosanoyl chloride
Shipping Conditions
Room Temperature

Chemical Information

Hexacosanoyl Chloride
CAS Number145411-41-2
PubChem CID11845895
IUPAC Namehexacosanoyl chloride
Molecular FormulaC26H51ClO
Molecular Weight415.1
XLogP12.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count24
Heavy Atom Count28
Formal Charge0
Complexity303
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)Cl
InChI
InChI=1S/C26H51ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h2-25H2,1H3
InChIKey
KXHFYBWOKFEEMI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexacosanoyl Chloride
CAS: 145411-41-2
CID: 11845895
Formula: C26H51ClO
MW: 415.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight415.1
XLogP312.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count24
Exact Mass414.3628439
Monoisotopic Mass414.3628439
Topological Polar Surface Area17.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity303
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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