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Home > Fluorides > 1588441-30-8
1588441-30-8 | Phenol, 4-fluoro-2-methyl-6-nitro-
CAS No: 1588441-30-8 Catalog No: AG001QYC MDL No:MFCD27923653
Product Description
Catalog Number:
AG001QYC
Chemical Name:
Phenol, 4-fluoro-2-methyl-6-nitro-
CAS Number:
1588441-30-8
Molecular Formula:
C7H6FNO3
Molecular Weight:
171.1258
MDL Number:
MFCD27923653
IUPAC Name:
4-fluoro-2-methyl-6-nitrophenol
InChI:
InChI=1S/C7H6FNO3/c1-4-2-5(8)3-6(7(4)10)9(11)12/h2-3,10H,1H3
InChI Key:
YSSPDRCAPPNOIU-UHFFFAOYSA-N
SMILES:
Fc1cc(C)c(c(c1)[N+](=O)[O-])O
Properties
Complexity:
182
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:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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