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benzyl (2R)-2-hydroxy-4-methylpentanoate

benzyl (2R)-2-hydroxy-4-methylpentanoate

Formula: C13H18O3

SMILES: CC(C)C[C@@H](O)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl (2R)-2-hydroxy-4-methylpentanoate

InChI: InChI=1S/C13H18O3/c1-10(2)8-12(14)13(15)16-9-11-6-4-3-5-7-11/h3-7,10,12,14H,8-9H2,1-2H3/t12-/m1/s1

Composition: C (70.24%), H (8.16%), O (21.59%)

Molar Mass: 222.284

Atom Count: 34

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 222.12559444
Formal Charge 0
FSP3 0.46
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LNYCLASVFGVAII-GFCCVEGCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.9
Topological Polar Surface Area 46.53
Polarizability 24.6
Ring Count 1
Rotatable Bond Count 6

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H18O3 $791.00-$2,970.00$791.00$1,700.00$2,970.00
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