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Home > Fluorides > 175840-70-7
175840-70-7 | 2-Heptanol, 1,1,1-trifluoro-, (2R)-
CAS No: 175840-70-7 Catalog No: AG00217V MDL No:
Product Description
Catalog Number:
AG00217V
Chemical Name:
2-Heptanol, 1,1,1-trifluoro-, (2R)-
CAS Number:
175840-70-7
Molecular Formula:
C7H13F3O
Molecular Weight:
170.1727
IUPAC Name:
(2R)-1,1,1-trifluoroheptan-2-ol
InChI:
InChI=1S/C7H13F3O/c1-2-3-4-5-6(11)7(8,9)10/h6,11H,2-5H2,1H3/t6-/m1/s1
InChI Key:
YFVHSPAONQXAIB-ZCFIWIBFSA-N
SMILES:
CCCCC[C@H](C(F)(F)F)O
Properties
Complexity:
100
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
170.092g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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