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2-(6-chloro-2-fluoro-3-methylphenyl)ethanimidamide

2-(6-chloro-2-fluoro-3-methylphenyl)ethanimidamide

CAS: 1260683-41-7

Formula: C9H10ClFN2

SMILES: CC1=CC=C(Cl)C(CC(N)=N)=C1F

IUPAC: 2-(6-chloro-2-fluoro-3-methylphenyl)ethanimidamide

InChI: InChI=1S/C9H10ClFN2/c1-5-2-3-7(10)6(9(5)11)4-8(12)13/h2-3H,4H2,1H3,(H3,12,13)

Composition: C (53.88%), H (5.02%), Cl (17.67%), F (9.47%), N (13.96%)

Molar Mass: 200.64

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 200.0516542
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey NFGZDBVDLSRPDN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.84
Topological Polar Surface Area 49.87
Polarizability 19.21
Ring Count 1
Rotatable Bond Count 2

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