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138690-33-2 | Heptanoyl chloride, 7,7,7-trifluoro-
CAS No: 138690-33-2 Catalog No: AG001911 MDL No:
Product Description
Catalog Number:
AG001911
Chemical Name:
Heptanoyl chloride, 7,7,7-trifluoro-
CAS Number:
138690-33-2
Molecular Formula:
C7H10ClF3O
Molecular Weight:
202.6019
IUPAC Name:
7,7,7-trifluoroheptanoyl chloride
InChI:
InChI=1S/C7H10ClF3O/c8-6(12)4-2-1-3-5-7(9,10)11/h1-5H2
InChI Key:
AMFCRYAHQONYSI-UHFFFAOYSA-N
SMILES:
ClC(=O)CCCCCC(F)(F)F
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.037g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.601g/mol
Monoisotopic Mass:
202.037g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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