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77582-61-7 | Heneicosanoyl chloride
CAS No: 77582-61-7 Catalog No: AG005GPG MDL No:
Product Description
Catalog Number:
AG005GPG
Chemical Name:
Heneicosanoyl chloride
CAS Number:
77582-61-7
Molecular Formula:
C21H41ClO
Molecular Weight:
345.0026
IUPAC Name:
henicosanoyl chloride
InChI:
InChI=1S/C21H41ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3
InChI Key:
MJVAHIFGHLKMKL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCC(=O)Cl
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.285g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.008g/mol
Monoisotopic Mass:
344.285g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
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