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4-hydroxybutanenitrile

4-hydroxybutanenitrile

CAS: 628-22-8

Formula: C4H7NO

SMILES: OCCCC#N

IUPAC: 4-hydroxybutanenitrile

InChI: InChI=1S/C4H7NO/c5-3-1-2-4-6/h6H,1-2,4H2

Composition: C (56.45%), H (8.29%), N (16.46%), O (18.80%)

Molar Mass: 85.106

Atom Count: 13

Heavy Atom Count: 6

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 85.052763849
Formal Charge 0
FSP3 0.75
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BAQQRABCRRQRSR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 22.78
Topological Polar Surface Area 44.02
Polarizability 8.58
Ring Count 0
Rotatable Bond Count 2

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Life Chemicals USA, Inc.
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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 628-22-8 $202.95-$1,470.15$202.95$316.80$430.65$905.85$1,168.20$1,470.15
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Struchem co.,ltd
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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 628-22-8 $150.00-$420.00$150.00$420.00
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