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Home > Fluorides > 1160474-68-9
1160474-68-9 | Benzenemethanol, 2,5-difluoro-4-nitro-
CAS No: 1160474-68-9 Catalog No: AG000BH1 MDL No:MFCD09909606
Product Description
Catalog Number:
AG000BH1
Chemical Name:
Benzenemethanol, 2,5-difluoro-4-nitro-
CAS Number:
1160474-68-9
Molecular Formula:
C7H5F2NO3
Molecular Weight:
189.1163
MDL Number:
MFCD09909606
IUPAC Name:
(2,5-difluoro-4-nitrophenyl)methanol
InChI:
InChI=1S/C7H5F2NO3/c8-5-2-7(10(12)13)6(9)1-4(5)3-11/h1-2,11H,3H2
InChI Key:
RBUYLUYPBHZOCB-UHFFFAOYSA-N
SMILES:
OCc1cc(F)c(cc1F)[N+](=O)[O-]
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.118g/mol
Monoisotopic Mass:
189.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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