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4-fluoro-3-methylbenzene-1,2-diamine hydrochloride

4-fluoro-3-methylbenzene-1,2-diamine hydrochloride

CAS: 485832-95-9

Formula: C7H10ClFN2

SMILES: Cl.CC1=C(F)C=CC(N)=C1N

IUPAC: 4-fluoro-3-methylbenzene-1,2-diamine hydrochloride

InChI: InChI=1S/C7H9FN2.ClH/c1-4-5(8)2-3-6(9)7(4)10;/h2-3H,9-10H2,1H3;1H

Composition: C (47.60%), H (5.71%), Cl (20.07%), F (10.76%), N (15.86%)

Molar Mass: 176.62

Atom Count: 21

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 176.0516542
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey IKQNHVNODYROFA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.72
Topological Polar Surface Area 52.04
Polarizability 14.05
Ring Count 1
Rotatable Bond Count 0

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97% <14 Days 485832-95-9 $147.42-$552.83$147.42$552.83
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