Home Other Building Blocks 2,5-dimethylpiperidin-4-one hydrochloride, Mixture of diastereomers

2,5-dimethylpiperidin-4-one hydrochloride, Mixture of diastereomers

CAS No.:
102074-04-4
Catalog Number:
AG01DX73
Molecular Formula:
C7H14ClNO
Molecular Weight:
163.6452
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Product Description
Catalog Number:
AG01DX73
Chemical Name:
2,5-dimethylpiperidin-4-one hydrochloride, Mixture of diastereomers
CAS Number:
102074-04-4
Molecular Formula:
C7H14ClNO
Molecular Weight:
163.6452
MDL Number:
MFCD31616164
IUPAC Name:
2,5-dimethylpiperidin-4-one;hydrochloride
InChI:
InChI=1S/C7H13NO.ClH/c1-5-4-8-6(2)3-7(5)9;/h5-6,8H,3-4H2,1-2H3;1H
InChI Key:
YAPQBEFDWHJHJQ-UHFFFAOYSA-N
SMILES:
CC1NCC(C(=O)C1)C.Cl
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.076g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
163.645g/mol
Monoisotopic Mass:
163.076g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties