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benzyl N-[(1R,2S)-2-hydroxycycloheptyl]carbamate

benzyl N-[(1R,2S)-2-hydroxycycloheptyl]carbamate

Formula: C15H21NO3

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

IUPAC: benzyl N-[(1R,2S)-2-hydroxycycloheptyl]carbamate

InChI: InChI=1S/C15H21NO3/c17-14-10-6-2-5-9-13(14)16-15(18)19-11-12-7-3-1-4-8-12/h1,3-4,7-8,13-14,17H,2,5-6,9-11H2,(H,16,18)/t13-,14+/m1/s1

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 2
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 AMGAYIMPQQNONB-KGLIPLIRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.58
Topological Polar Surface Area 58.56
Polarizability 28.69
Ring Count 2
Rotatable Bond Count 4

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J&W PHARMLAB LLC
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Purity LeadTime Formula PacketSize UnitPrice
96% <2 Days C15H21NO3 $631.35-$7,912.00$631.35$1,147.70$2,162.00$7,912.00
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