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methyl 3-(4-chlorophenyl)-1H-indole-2-carboxylate

methyl 3-(4-chlorophenyl)-1H-indole-2-carboxylate

CAS: 1134334-35-2

Formula: C16H12ClNO2

SMILES: COC(=O)C1=C(C2=CC=CC=C2N1)C1=CC=C(Cl)C=C1

IUPAC: methyl 3-(4-chlorophenyl)-1H-indole-2-carboxylate

InChI: InChI=1S/C16H12ClNO2/c1-20-16(19)15-14(10-6-8-11(17)9-7-10)12-4-2-3-5-13(12)18-15/h2-9,18H,1H3

Composition: C (67.26%), H (4.23%), Cl (12.41%), N (4.90%), O (11.20%)

Molar Mass: 285.73

Atom Count: 32

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 285.0556563
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey YWDGXKATXQOICS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.99
Topological Polar Surface Area 42.09
Polarizability 32.81
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1134334-35-2 $202.14$202.14
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