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4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile

CAS: 238088-16-9

Formula: C10H18BNO2

SMILES: CC1(C)OB(CCCC#N)OC1(C)C

IUPAC: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butanenitrile

InChI: InChI=1S/C10H18BNO2/c1-9(2)10(3,4)14-11(13-9)7-5-6-8-12/h5-7H2,1-4H3

Composition: C (61.57%), H (9.30%), B (5.54%), N (7.18%), O (16.40%)

Molar Mass: 195.07

Atom Count: 32

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 195.143059
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LVMSRWXPZLRTIC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.47
Topological Polar Surface Area 42.25
Polarizability 21.63
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 238088-16-9 $69.00-$207.00$69.00$207.00
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98% <7 Days 238088-16-9 $19.67-$31.05$19.67$31.05
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