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4-hydrazinyl-2-(trifluoromethyl)quinazoline

4-hydrazinyl-2-(trifluoromethyl)quinazoline

CAS: 154136-31-9

Formula: C9H7F3N4

SMILES: NNC1=NC(=NC2=CC=CC=C12)C(F)(F)F

IUPAC: 4-hydrazinyl-2-(trifluoromethyl)quinazoline

InChI: InChI=1S/C9H7F3N4/c10-9(11,12)8-14-6-4-2-1-3-5(6)7(15-8)16-13/h1-4H,13H2,(H,14,15,16)

Composition: C (47.37%), H (3.09%), F (24.98%), N (24.55%)

Molar Mass: 228.178

Atom Count: 23

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 228.06228073
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey OBZZCRXGECYMPR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.46
Topological Polar Surface Area 63.83
Polarizability 19.71
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 154136-31-9 $51.35-$225.06$51.35$63.37$86.31$143.12$225.06
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