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methyl (1R,3S)-3-hydroxycyclohexane-1-carboxylate

methyl (1R,3S)-3-hydroxycyclohexane-1-carboxylate

CAS: 6183-54-6

Formula: C8H14O3

SMILES: COC(=O)[C@@H]1CCC[C@H](O)C1

IUPAC: methyl (1R,3S)-3-hydroxycyclohexane-1-carboxylate

InChI: InChI=1S/C8H14O3/c1-11-8(10)6-3-2-4-7(9)5-6/h6-7,9H,2-5H2,1H3/t6-,7+/m1/s1

Composition: C (60.74%), H (8.92%), O (30.34%)

Molar Mass: 158.197

Atom Count: 25

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 158.094294311
Formal Charge 0
FSP3 0.87
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey OXQRLBFDJMSRMM-RQJHMYQMSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.28
Topological Polar Surface Area 46.53
Polarizability 16.16
Ring Count 1
Rotatable Bond Count 2

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97% <7 Days 6183-54-6 $137.45-$1,195.87$137.45$214.12$317.90$439.45$1,195.87
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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 6183-54-6 $60.53-$1,574.99$60.53$122.32$206.80$305.16$944.49$1,574.99
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