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68547-97-7 | 1,2,3,6-Tetrahydro-4-pyridinecarboxylic Acid Hydrochloride
CAS No: 68547-97-7 Catalog No: AG0032K2 MDL No:MFCD00055192
Product Description
Catalog Number:
AG0032K2
Chemical Name:
1,2,3,6-Tetrahydro-4-pyridinecarboxylic Acid Hydrochloride
CAS Number:
68547-97-7
Molecular Formula:
C6H10ClNO2
Molecular Weight:
163.6021
MDL Number:
MFCD00055192
IUPAC Name:
1,2,3,6-tetrahydropyridine-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H9NO2.ClH/c8-6(9)5-1-3-7-4-2-5;/h1,7H,2-4H2,(H,8,9);1H
InChI Key:
SUWREQRNTXCCBL-UHFFFAOYSA-N
SMILES:
OC(=O)C1=CCNCC1.Cl
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
163.601g/mol
Monoisotopic Mass:
163.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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