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5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid

5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid

CAS: 912454-38-7

Formula: C10H10BrNO3

SMILES: OC(=O)C1=CC(Br)=C(OCC2CC2)N=C1

IUPAC: 5-bromo-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid

InChI: InChI=1S/C10H10BrNO3/c11-8-3-7(10(13)14)4-12-9(8)15-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,13,14)

Composition: C (44.14%), H (3.70%), Br (29.37%), N (5.15%), O (17.64%)

Molar Mass: 272.098

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 270.984406
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey NDDUCEMRFZUCTI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.5
Topological Polar Surface Area 59.42
Polarizability 22.09
Ring Count 2
Rotatable Bond Count 4

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 912454-38-7 $51.35-$292.79$51.35$63.37$86.31$292.79
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