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(2S)-2-amino-3-(4-cyclohexylphenyl)propanoic acid hydrochloride

(2S)-2-amino-3-(4-cyclohexylphenyl)propanoic acid hydrochloride

CAS: 2703745-79-1

Formula: C15H22ClNO2

SMILES: Cl.N[C@@H](CC1=CC=C(C=C1)C1CCCCC1)C(O)=O

IUPAC: (2S)-2-amino-3-(4-cyclohexylphenyl)propanoic acid hydrochloride

InChI: InChI=1S/C15H21NO2.ClH/c16-14(15(17)18)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12;/h6-9,12,14H,1-5,10,16H2,(H,17,18);1H/t14-;/m0./s1

Composition: C (63.48%), H (7.81%), Cl (12.49%), N (4.94%), O (11.28%)

Molar Mass: 283.8

Atom Count: 41

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 283.1339067
Formal Charge 0
FSP3 0.53
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey VMLIVFUIGSPNDC-UQKRIMTDSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.31
Topological Polar Surface Area 63.32
Polarizability 28.13
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS UnitPrice
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95% <5 Days 2703745-79-1 $382.08-$588.89$382.08$588.89
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