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N-[4-(aminomethyl)phenyl]-2,5-bis(trifluoromethyl)benzamide

N-[4-(aminomethyl)phenyl]-2,5-bis(trifluoromethyl)benzamide

Formula: C16H12F6N2O

SMILES: NCC1=CC=C(NC(=O)C2=C(C=CC(=C2)C(F)(F)F)C(F)(F)F)C=C1

IUPAC: N-[4-(aminomethyl)phenyl]-2,5-bis(trifluoromethyl)benzamide

InChI: InChI=1S/C16H12F6N2O/c17-15(18,19)10-3-6-13(16(20,21)22)12(7-10)14(25)24-11-4-1-9(8-23)2-5-11/h1-7H,8,23H2,(H,24,25)

Composition: C (53.05%), H (3.34%), F (31.47%), N (7.73%), O (4.42%)

Molar Mass: 362.275

Atom Count: 37

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 362.085381992
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey CZZWNLSTVTXFRE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 82.01
Topological Polar Surface Area 55.12
Polarizability 28.71
Ring Count 2
Rotatable Bond Count 5

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Purity (%)
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Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C16H12F6N2O $1,280.00-$1,901.00$1,280.00$1,901.00
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