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2-chloro-5-(trifluoromethyl)aniline

2-chloro-5-(trifluoromethyl)aniline

CAS: 121-50-6

Formula: C7H5ClF3N

SMILES: NC1=CC(=CC=C1Cl)C(F)(F)F

IUPAC: 2-chloro-5-(trifluoromethyl)aniline

InChI: InChI=1S/C7H5ClF3N/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3H,12H2

Composition: C (42.99%), H (2.58%), Cl (18.13%), F (29.14%), N (7.16%)

Molar Mass: 195.57

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 195.0062614
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VKTTYIXIDXWHKW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.54
Topological Polar Surface Area 26.02
Polarizability 14.66
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 121-50-6 $5.75-$9.20$5.75$8.05$9.20
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98% <7 Days 121-50-6 $5.18-$7.25$5.18$6.21$6.21$7.25
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