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1-(6-chloropyridin-3-yl)-2-methylpropan-1-one

1-(6-chloropyridin-3-yl)-2-methylpropan-1-one

CAS: 244263-45-4

Formula: C9H10ClNO

SMILES: CC(C)C(=O)C1=CC=C(Cl)N=C1

IUPAC: 1-(6-chloropyridin-3-yl)-2-methylpropan-1-one

InChI: InChI=1S/C9H10ClNO/c1-6(2)9(12)7-3-4-8(10)11-5-7/h3-6H,1-2H3

Composition: C (58.87%), H (5.49%), Cl (19.30%), N (7.63%), O (8.71%)

Molar Mass: 183.64

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 183.0450916
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey YHXOBWLYRVQSDI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.37
Topological Polar Surface Area 29.96
Polarizability 18.79
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 244263-45-4 $1,460.00-$2,060.00$1,460.00$1,700.00$2,060.00
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