Home Carboxys rac-(2R,4r,6S)-2,6-dimethylpiperidine-4-carboxylic acid hydrochloride

rac-(2R,4r,6S)-2,6-dimethylpiperidine-4-carboxylic acid hydrochloride

CAS No.:
2094020-19-4
Catalog Number:
AG01BXQP
Molecular Formula:
C8H16ClNO2
Molecular Weight:
193.6711
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Product Description
Catalog Number:
AG01BXQP
Chemical Name:
rac-(2R,4r,6S)-2,6-dimethylpiperidine-4-carboxylic acid hydrochloride
CAS Number:
2094020-19-4
Molecular Formula:
C8H16ClNO2
Molecular Weight:
193.6711
MDL Number:
MFCD30730472
IUPAC Name:
(2R,6S)-2,6-dimethylpiperidine-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H15NO2.ClH/c1-5-3-7(8(10)11)4-6(2)9-5;/h5-7,9H,3-4H2,1-2H3,(H,10,11);1H/t5-,6+,7?;
InChI Key:
NDFWKHGECKXNKR-VPEOJXMDSA-N
SMILES:
C[C@@H]1C[C@@H](C[C@@H](N1)C)C(=O)O.Cl
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
193.087g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
193.671g/mol
Monoisotopic Mass:
193.087g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties