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ethyl 2-chloro-2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]acetate

ethyl 2-chloro-2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]acetate

CAS: 112091-27-7

Formula: C10H9Cl2N3O4

SMILES: CCOC(=O)C(Cl)N=NC1=C(C=C(Cl)C=C1)[N+]([O-])=O

IUPAC: ethyl 2-chloro-2-[2-(4-chloro-2-nitrophenyl)diazen-1-yl]acetate

InChI: InChI=1/C10H9Cl2N3O4/c1-2-19-10(16)9(12)14-13-7-4-3-6(11)5-8(7)15(17)18/h3-5,9H,2H2,1H3

Composition: C (39.24%), H (2.96%), Cl (23.16%), N (13.73%), O (20.91%)

Molar Mass: 306.1

Atom Count: 28

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 304.9970112
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey LCCVSIWHPYQPQD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.05
Topological Polar Surface Area 94.16
Polarizability 26.01
Ring Count 1
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 112091-27-7 $51.35-$359.43$51.35$63.37$75.38$86.31$120.18$359.43
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