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4-(3-aminophenyl)-1,2-dimethyl-1,2,4-triazolidine-3,5-dione

4-(3-aminophenyl)-1,2-dimethyl-1,2,4-triazolidine-3,5-dione

CAS: 1160263-99-9

Formula: C10H12N4O2

SMILES: CN1N(C)C(=O)N(C1=O)C1=CC(N)=CC=C1

IUPAC: 4-(3-aminophenyl)-1,2-dimethyl-1,2,4-triazolidine-3,5-dione

InChI: InChI=1S/C10H12N4O2/c1-12-9(15)14(10(16)13(12)2)8-5-3-4-7(11)6-8/h3-6H,11H2,1-2H3

Composition: C (54.54%), H (5.49%), N (25.44%), O (14.53%)

Molar Mass: 220.232

Atom Count: 28

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 220.096025642
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LABROZRLPSCPEO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.95
Topological Polar Surface Area 69.88
Polarizability 21.69
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1160263-99-9 $297.85-$1,189.10$297.85$1,189.10
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