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63878-73-9 | (2-Fluoro-5-nitrophenyl)methanol
CAS No: 63878-73-9 Catalog No: AG003BN6 MDL No:MFCD02683502
Product Description
Catalog Number:
AG003BN6
Chemical Name:
(2-Fluoro-5-nitrophenyl)methanol
CAS Number:
63878-73-9
Molecular Formula:
C7H6FNO3
Molecular Weight:
171.1258
MDL Number:
MFCD02683502
IUPAC Name:
(2-fluoro-5-nitrophenyl)methanol
InChI:
InChI=1S/C7H6FNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-3,10H,4H2
InChI Key:
IFIOUOYJVOSTFH-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1F)[N+](=O)[O-]
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.127g/mol
Monoisotopic Mass:
171.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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