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102071-74-9 | Benzenepropanol, α,α-bis(chlorodifluoromethyl)-
CAS No: 102071-74-9 Catalog No: AG0006I5 MDL No:
Product Description
Catalog Number:
AG0006I5
Chemical Name:
Benzenepropanol, α,α-bis(chlorodifluoromethyl)-
CAS Number:
102071-74-9
Molecular Formula:
C11H10Cl2F4O
Molecular Weight:
305.0961
IUPAC Name:
1-chloro-2-[chloro(difluoro)methyl]-1,1-difluoro-4-phenylbutan-2-ol
InChI:
InChI=1S/C11H10Cl2F4O/c12-10(14,15)9(18,11(13,16)17)7-6-8-4-2-1-3-5-8/h1-5,18H,6-7H2
InChI Key:
XSUWAXSZANBTQJ-UHFFFAOYSA-N
SMILES:
OC(C(Cl)(F)F)(C(Cl)(F)F)CCc1ccccc1
NSC Number:
160021
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.004g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.094g/mol
Monoisotopic Mass:
304.004g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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