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tert-butyl cyclopentanecarboxylate

tert-butyl cyclopentanecarboxylate

CAS: 87661-18-5

Formula: C10H18O2

SMILES: CC(C)(C)OC(=O)C1CCCC1

IUPAC: tert-butyl cyclopentanecarboxylate

InChI: InChI=1S/C10H18O2/c1-10(2,3)12-9(11)8-6-4-5-7-8/h8H,4-7H2,1-3H3

Composition: C (70.55%), H (10.66%), O (18.79%)

Molar Mass: 170.252

Atom Count: 30

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 170.13067982
Formal Charge 0
FSP3 0.9
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WQNHTMOGCGLHIZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.82
Topological Polar Surface Area 26.3
Polarizability 19.18
Ring Count 1
Rotatable Bond Count 3

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Purity (%)
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Ships Within
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Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 87661-18-5 $94.08-$423.36$94.08$141.12$423.36
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