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1-(2,5-dimethoxyphenyl)cyclopropane-1-carbonitrile

1-(2,5-dimethoxyphenyl)cyclopropane-1-carbonitrile

Formula: C12H13NO2

SMILES: COC1=CC(=C(OC)C=C1)C1(CC1)C#N

IUPAC: 1-(2,5-dimethoxyphenyl)cyclopropane-1-carbonitrile

InChI: InChI=1S/C12H13NO2/c1-14-9-3-4-11(15-2)10(7-9)12(8-13)5-6-12/h3-4,7H,5-6H2,1-2H3

Composition: C (70.92%), H (6.45%), N (6.89%), O (15.74%)

Molar Mass: 203.241

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 203.094628663
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LHSCSFAJIIBMNO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.54
Topological Polar Surface Area 42.25
Polarizability 21.84
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C12H13NO2 $1,460.00-$3,190.00$1,460.00$1,700.00$3,190.00
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