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ethyl 2-bromo-2-ethylbutanoate

ethyl 2-bromo-2-ethylbutanoate

CAS: 6937-28-6

Formula: C8H15BrO2

SMILES: CCOC(=O)C(Br)(CC)CC

IUPAC: ethyl 2-bromo-2-ethylbutanoate

InChI: InChI=1S/C8H15BrO2/c1-4-8(9,5-2)7(10)11-6-3/h4-6H2,1-3H3

Composition: C (43.07%), H (6.78%), Br (35.81%), O (14.34%)

Molar Mass: 223.11

Atom Count: 26

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 222.025543
Formal Charge 0
FSP3 0.87
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey YIFZOOLBLJRSBG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.15
Topological Polar Surface Area 26.3
Polarizability 19.02
Ring Count 0
Rotatable Bond Count 5

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 6937-28-6 $12.42-$153.18$12.42$18.63$49.68$86.94$153.18
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