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tert-butyl 2-hydroxy-3-methylbutanoate

tert-butyl 2-hydroxy-3-methylbutanoate

Formula: C9H18O3

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

IUPAC: tert-butyl 2-hydroxy-3-methylbutanoate

InChI: InChI=1/C9H18O3/c1-6(2)7(10)8(11)12-9(3,4)5/h6-7,10H,1-5H3

Composition: C (62.04%), H (10.41%), O (27.55%)

Molar Mass: 174.24

Atom Count: 30

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 174.12559444
Formal Charge 0
FSP3 0.89
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XQTIFSCLEWPKCF-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.41
Topological Polar Surface Area 46.53
Polarizability 18.71
Ring Count 0
Rotatable Bond Count 4

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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C9H18O3 Quote Only
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