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141583-89-3 | 3-Nonanol, 2-chloro-1,1,1-trifluoro-3-methyl-
CAS No: 141583-89-3 Catalog No: AG001GMU MDL No:
Product Description
Catalog Number:
AG001GMU
Chemical Name:
3-Nonanol, 2-chloro-1,1,1-trifluoro-3-methyl-
CAS Number:
141583-89-3
Molecular Formula:
C10H18ClF3O
Molecular Weight:
246.6975
IUPAC Name:
2-chloro-1,1,1-trifluoro-3-methylnonan-3-ol
InChI:
InChI=1S/C10H18ClF3O/c1-3-4-5-6-7-9(2,15)8(11)10(12,13)14/h8,15H,3-7H2,1-2H3
InChI Key:
XMFPJBANVAVJQB-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(C(F)(F)F)Cl)(O)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.698g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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