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4-chloro-5,7-dimethylpyrrolo[2,1-f][1,2,4]triazine

4-chloro-5,7-dimethylpyrrolo[2,1-f][1,2,4]triazine

CAS: 1554317-34-8

Formula: C8H8ClN3

SMILES: CC1=CC(C)=C2N1N=CN=C2Cl

IUPAC: 4-chloro-5,7-dimethylpyrrolo[2,1-f][1,2,4]triazine

InChI: InChI=1S/C8H8ClN3/c1-5-3-6(2)12-7(5)8(9)10-4-11-12/h3-4H,1-2H3

Composition: C (52.91%), H (4.44%), Cl (19.52%), N (23.14%)

Molar Mass: 181.62

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 181.040675
Formal Charge 0
FSP3 0.25
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey RWBPCTYDIXDWPA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.86
Topological Polar Surface Area 30.19
Polarizability 18.55
Ring Count 2
Rotatable Bond Count 0

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95% <5 Days 1554317-34-8 $685.98-$1,081.94$685.98$1,081.94
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