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234443-21-1 | 1-Butanol, 4-bromo-3,3,4,4-tetrafluoro-
CAS No: 234443-21-1 Catalog No: AG002N96 MDL No:MFCD00077467
Product Description
Catalog Number:
AG002N96
Chemical Name:
1-Butanol, 4-bromo-3,3,4,4-tetrafluoro-
CAS Number:
234443-21-1
Molecular Formula:
C4H5BrF4O
Molecular Weight:
224.9795
MDL Number:
MFCD00077467
IUPAC Name:
4-bromo-3,3,4,4-tetrafluorobutan-1-ol
InChI:
InChI=1S/C4H5BrF4O/c5-4(8,9)3(6,7)1-2-10/h10H,1-2H2
InChI Key:
RTTCOQHNKANLOS-UHFFFAOYSA-N
SMILES:
OCCC(C(Br)(F)F)(F)F
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.946g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.981g/mol
Monoisotopic Mass:
223.946g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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