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2-(oxan-2-yloxy)acetonitrile

2-(oxan-2-yloxy)acetonitrile

CAS: 17521-49-2

Formula: C7H11NO2

SMILES: N#CCOC1CCCCO1

IUPAC: 2-(oxan-2-yloxy)acetonitrile

InChI: InChI=1/C7H11NO2/c8-4-6-10-7-3-1-2-5-9-7/h7H,1-3,5-6H2

Composition: C (59.56%), H (7.85%), N (9.92%), O (22.67%)

Molar Mass: 141.17

Atom Count: 21

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 141.078978598
Formal Charge 0
FSP3 0.86
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YADWCNNOFHOBBG-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.11
Topological Polar Surface Area 42.25
Polarizability 14.16
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 17521-49-2 $59.00-$613.76$59.00$104.54$149.04$208.04$613.76
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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 17521-49-2 $175.95-$312.80$175.95$312.80
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