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methyl 2,3-dihydro-1H-indole-6-carboxylate

methyl 2,3-dihydro-1H-indole-6-carboxylate

CAS: 341988-36-1

Formula: C10H11NO2

SMILES: COC(=O)C1=CC=C2CCNC2=C1

IUPAC: methyl 2,3-dihydro-1H-indole-6-carboxylate

InChI: InChI=1S/C10H11NO2/c1-13-10(12)8-3-2-7-4-5-11-9(7)6-8/h2-3,6,11H,4-5H2,1H3

Composition: C (67.78%), H (6.26%), N (7.90%), O (18.06%)

Molar Mass: 177.203

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 177.078978598
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IVFIWGSRKYSLLR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.59
Topological Polar Surface Area 38.33
Polarizability 18.77
Ring Count 2
Rotatable Bond Count 2

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95% <5 Days 341988-36-1 $49.18-$1,025.19$49.18$81.97$187.89$590.15$1,025.19
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95% <2 Days 341988-36-1 $120.75-$3,447.70$120.75$143.75$171.35$227.70$917.70$3,447.70
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