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116874-67-0 | Benzenamine, 2-fluoro-5-(1-methylethyl)-
CAS No: 116874-67-0 Catalog No: AG000DC4 MDL No:
Product Description
Catalog Number:
AG000DC4
Chemical Name:
Benzenamine, 2-fluoro-5-(1-methylethyl)-
CAS Number:
116874-67-0
Molecular Formula:
C9H12FN
Molecular Weight:
153.1967
IUPAC Name:
2-fluoro-5-propan-2-ylaniline
InChI:
InChI=1S/C9H12FN/c1-6(2)7-3-4-8(10)9(11)5-7/h3-6H,11H2,1-2H3
InChI Key:
QWYOGCVSPQTKPM-UHFFFAOYSA-N
SMILES:
CC(c1ccc(c(c1)N)F)C
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.2g/mol
Monoisotopic Mass:
153.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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