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122093-60-1 | Heptane, 1,3-dibromo-1,1-difluoro-
CAS No: 122093-60-1 Catalog No: AG0016QI MDL No:MFCD00155739
Product Description
Catalog Number:
AG0016QI
Chemical Name:
Heptane, 1,3-dibromo-1,1-difluoro-
CAS Number:
122093-60-1
Molecular Formula:
C7H12Br2F2
Molecular Weight:
293.9750
MDL Number:
MFCD00155739
IUPAC Name:
1,3-dibromo-1,1-difluoroheptane
InChI:
InChI=1S/C7H12Br2F2/c1-2-3-4-6(8)5-7(9,10)11/h6H,2-5H2,1H3
InChI Key:
LELCBNDIIJODHG-UHFFFAOYSA-N
SMILES:
CCCCC(CC(Br)(F)F)Br
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.925g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.978g/mol
Monoisotopic Mass:
291.927g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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