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ethyl 5-chloro-3-formyl-1H-indole-2-carboxylate

ethyl 5-chloro-3-formyl-1H-indole-2-carboxylate

CAS: 43142-76-3

Formula: C12H10ClNO3

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

IUPAC: ethyl 5-chloro-3-formyl-1H-indole-2-carboxylate

InChI: InChI=1S/C12H10ClNO3/c1-2-17-12(16)11-9(6-15)8-5-7(13)3-4-10(8)14-11/h3-6,14H,2H2,1H3

Composition: C (57.27%), H (4.01%), Cl (14.09%), N (5.57%), O (19.07%)

Molar Mass: 251.67

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 251.0349209
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JSJQTSYYPLBOFH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.18
Topological Polar Surface Area 59.16
Polarizability 25.58
Ring Count 2
Rotatable Bond Count 4

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Life Chemicals USA, Inc.
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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 43142-76-3 $79.20-$792.00$79.20$108.90$154.44$272.25$410.85$792.00
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96% <5 Days 43142-76-3 $79.44-$475.40$79.44$179.06$475.40
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J&W PHARMLAB LLC
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97% <2 Days 43142-76-3 $112.70-$1,897.50$112.70$135.70$149.50$184.00$483.00$1,897.50
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