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benzyl N-[(1s,4s)-4-(hydroxymethyl)cyclohexyl]carbamate

benzyl N-[(1s,4s)-4-(hydroxymethyl)cyclohexyl]carbamate

CAS: 1256276-45-5

Formula: C15H21NO3

SMILES: OC[C@H]1CC[C@H](CC1)NC(=O)OCC1=CC=CC=C1

IUPAC: benzyl N-[(1s,4s)-4-(hydroxymethyl)cyclohexyl]carbamate

InChI: InChI=1/C15H21NO3/c17-10-12-6-8-14(9-7-12)16-15(18)19-11-13-4-2-1-3-5-13/h1-5,12,14,17H,6-11H2,(H,16,18)/t12-,14+

Composition: C (68.42%), H (8.04%), N (5.32%), O (18.23%)

Molar Mass: 263.337

Atom Count: 40

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 263.15214354
Formal Charge 0
FSP3 0.53
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey XCUWJTPPKGZEAN-XBXGTLAGNA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.01
Topological Polar Surface Area 58.56
Polarizability 28.69
Ring Count 2
Rotatable Bond Count 5

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97% <5 Days 1256276-45-5 $22.70-$199.24$22.70$56.75$199.24
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