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methyl 2-cyanocyclopropane-1-carboxylate

methyl 2-cyanocyclopropane-1-carboxylate

Formula: C6H7NO2

SMILES: COC(=O)C1CC1C#N

IUPAC: methyl 2-cyanocyclopropane-1-carboxylate

InChI: InChI=1/C6H7NO2/c1-9-6(8)5-2-4(5)3-7/h4-5H,2H2,1H3

Composition: C (57.59%), H (5.64%), N (11.19%), O (25.57%)

Molar Mass: 125.127

Atom Count: 16

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 125.047678469
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BQUCYKMMQHQPOA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.03
Topological Polar Surface Area 50.09
Polarizability 11.73
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C6H7NO2 $51.43-$1,512.83$51.43$86.02$241.23$890.12$1,512.83
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Purity LeadTime Formula PacketSize UnitPrice
95% <10 Days C6H7NO2 $162.27$162.27
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98% <10 Days C6H7NO2 Quote Only
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